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Using benzyl (S)-2-((tert-butoxycarbonyl)amino)-3-(3-(5-(4-methoxybenzyl)-1,1-dioxido-4-oxo-1,2,5-thiadiazolidin-2-yl)phenyl)propanoate to produce (S)-2-((tert-butoxycarbonyl)amino)-3-(3-(5-(4-methoxybenzyl)-1,1-dioxido-4-oxo-1,2,5-thiadiazolidin-2-yl)phenyl)propanoic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCOC(C)=O", "CCO"], "agent": ["[H][H]", "[Pd]"]} |
Using carbonate, 5'-hydroxyspiro[cyclopentane-1,1'-inden]-3'(2'H)-one to produce 5'-methoxyspiro[cyclopentane-1,1'-inden]-3'(2'H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CI", "CC(C)=O"], "agent": ["[K+]"]} |
Using 4-bromo-1-fluoro-2-nitrobenzene to produce 5-bromo-2-fluoroaniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO", "O"], "agent": ["[Na+]", "[OH-]"]} |
Using 1-(1-(4-fluorophenethyl)piperidin-4-yl)indoline-6-carbaldehyde, hydroxylammonium to produce 1-(1-(4-fluorophenethyl)piperidin-4-yl)indoline-6-carbaldehyde oxime, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["[Cl-]", "[Na+]", "CC(=O)[O-]"]} |
Using (2-methyl-4-nitrophenyl)methanol, tribromophosphane to produce 1-(bromomethyl)-2-methyl-4-nitrobenzene, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl"], "agent": ["[Na+]", "O=C([O-])O"]} |
Using 3-cyanobenzoyl chloride, 1-(2,6-dihydroxy-4-morpholinophenyl)ethan-1-one to produce 3-(5-hydroxy-7-morpholino-4-oxo-4H-chromen-2-yl)benzonitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CC(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using methyl 6-cyclohexyl-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylate to produce 6-cyclohexyl-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Na+]", "[OH-]"]} |
Using methanesulfonyl chloride, 3-fluoro-5-iodoaniline to produce N-(3-fluoro-5-iodophenyl)methanesulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "CCN(CC)CC"], "agent": ["Cl"]} |
Using methyl 2-bromoacetate, 5-bromo-1-((4-methoxyphenyl)sulfonyl)-1H-indol-3-ol to produce methyl 2-((5-bromo-1-((4-methoxyphenyl)sulfonyl)-1H-indol-3-yl)oxy)acetate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC#N"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using (5-(1,1-dioxido-2,3-dihydrobenzo[d]thiazole-3-carbonyl)-2-methoxy-3-(trifluoromethyl)phenyl)(1,1-dioxidothiazolidin-3-yl)methanone to produce (5-(1,1-dioxido-2,3-dihydrobenzo[d]thiazole-3-carbonyl)-2-hydroxy-3-(trifluoromethyl)phenyl)(1,1-dioxidothiazolidin-3-yl)methanone, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Cl-]", "[Li+]", "Cl"]} |
Using methyl 2-(2-chloro-5-(4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-4-fluorophenoxy)propanoate to produce 2-(2-chloro-5-(4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-4-fluorophenoxy)propanoic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CCO"], "agent": ["[K+]", "Cl", "[OH-]"]} |
Using 2-phenylimidazo[1,2-c]pyrimidin-7-amine, 4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid to produce 4-chloro-1-methyl-N-(2-phenylimidazo[1,2-c]pyrimidin-7-yl)-1H-pyrazole-5-carboxamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "CCN(C(C)C)C(C)C"], "agent": ["CN(C)C(On1nnc2ccccc21)=[N+](C)C", "F[B-](F)(F)F"]} |
Using ethyl 2-(5-(3-(((4-formyl-6-methoxypyridin-3-yl)oxy)methyl)pyridin-2-yl)-1H-pyrazol-1-yl)acetate to produce 2-(5-(3-(((4-formyl-6-methoxypyridin-3-yl)oxy)methyl)pyridin-2-yl)-1H-pyrazol-1-yl)acetic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Na+]", "[OH-]"]} |
Using 6-(4-bromobutoxy)-3,4-dihydroquinolin-2(1H)-one, pyridine-2-thiol to produce 6-(4-(pyridin-2-ylthio)butoxy)-3,4-dihydroquinolin-2(1H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CS(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using tert-butyl (S)-((7-benzyl-1-(5-hydroxyhexyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)carbamate to produce tert-butyl (S)-((1-(5-hydroxyhexyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)carbamate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["[H][H]", "[Pd]"]} |
Using 2-(4-((6-chloro-3-nitroquinolin-4-yl)amino)phenyl)-2-methylpropanenitrile to produce 2-(4-((3-amino-6-chloroquinolin-4-yl)amino)phenyl)-2-methylpropanenitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Ni]"]} |
Using 4-(3-nitrophenyl)thiazol-2-amine, 3,4-dichlorobenzenesulfonyl chloride to produce 3,4-dichloro-N-(4-(3-nitrophenyl)thiazol-2-yl)benzenesulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["c1ccncc1"], "agent": ["Cl"]} |
Using aceticacid, (E)-10-(hydroxyimino)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazin-4-one to produce N-(4-oxo-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazin-10-yl)acetamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CN(C)C=O"], "agent": ["C", "[Zn]"]} |
Using methyl 4-(1H-1,2,4-triazol-1-yl)-2-(trifluoromethyl)benzoate to produce 4-(1H-1,2,4-triazol-1-yl)-2-(trifluoromethyl)benzoic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CO"], "agent": ["[Na+]", "[OH-]"]} |
Using 1-(4-(4-chloro-2-fluorophenyl)pyridin-3-yl)ethan-1-ol to produce 8-chloro-5-methyl-5H-chromeno[3,4-c]pyridine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "[H-]"]} |
Using N,N-dimethyl-2-((methylsulfonyl)oxy)ethan-1-aminium, ethyl 4-hydroxybenzoate to produce ethyl 4-(2-(dimethylamino)ethoxy)benzoate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC(=O)O", "COCCOC"], "agent": ["[Cl-]", "[Na+]", "[OH-]"]} |
Using 3-(1-(1,4-dioxaspiro[4.5]decan-8-yl)propyl)-1,1-dimethylurea to produce 1,1-dimethyl-3-(1-(4-oxocyclohexyl)propyl)urea, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC#N"], "agent": ["Cl"]} |
Using (Z)-5-(2-(3-(dimethylamino)pyrrolidin-1-yl)-5-nitrobenzylidene)thiazolidine-2,4-dione to produce (Z)-5-(5-amino-2-(3-(dimethylamino)pyrrolidin-1-yl)benzylidene)thiazolidine-2,4-dione, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CO"], "agent": ["[Fe]", "Cl"]} |
Using tert-butyl (4-(7-bromo-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl)butyl)carbamate to produce 4-(7-bromo-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl)butan-1-amine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["Cl"]} |
Using tert-butyl (S)-4-((5'-(aminomethyl)-2'-fluoro-[1,1'-biphenyl]-3-yl)methyl)-2-methylpiperazine-1-carboxylate, 2-(((1,6-diethyl-4-((tetrahydro-2H-pyran-4-yl)amino)-1H-pyrazolo[3,4-b]pyridin-5-yl)methyl)carbamoyl)pentanoic acid to produce tert-butyl (2S)-4-((5'-((2-(((1,6-diethyl-4-((tetrahydro-2H-pyran-4-yl)amino)-1H-pyrazolo[3,4-b]pyridin-5-yl)methyl)carbamoyl)pentanamido)methyl)-2'-fluoro-[1,1'-biphenyl]-3-yl)methyl)-2-methylpiperazine-1-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "CCN(CC)CC"], "agent": ["F[P-](F)(F)(F)(F)F", "CN(C)C(On1nnc2ccccc21)=[N+](C)C"]} |
Using tert-butyl (2R,4S)-4-(cyclopropanesulfonamido)-2-ethylpyrrolidine-1-carboxylate to produce N-((3S,5R)-5-ethylpyrrolidin-3-yl)cyclopropanesulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["Cl"]} |
Using 3-chloro-7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazino[6,5-g]isoquinoline 1-oxide, tetraethylstannane to produce 3-ethyl-7-methyl-6,7,8,9-tetrahydro-[1,2,4]triazino[6,5-g]isoquinoline 1-oxide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["COCCOC"], "agent": ["N#N", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using propylamine, ethyl 4-(2-propyl-1H-imidazo[4,5-c]quinolin-1-yl)butanoate to produce N-propyl-4-(2-propyl-1H-imidazo[4,5-c]quinolin-1-yl)butanamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "Cc1ccccc1"], "agent": ["C[Al](C)C"]} |
Using (3-amino-5-nitrophenyl)boronic acid, 1-(5-bromothiazol-2-yl)cyclobutan-1-ol to produce 1-(5-(3-amino-5-nitrophenyl)thiazol-2-yl)cyclobutan-1-ol, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["COCCOC"], "agent": ["O=C([O-])[O-]", "[Na+]"]} |
Using 3-methylbutanal, 4-mercaptobutan-2-ol to produce 2-isobutyl-6-methyl-1,3-oxathiane, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCNCC", "ClCCl"], "agent": ["Cc1ccc(S(=O)(=O)O)cc1"]} |
Using tert-butyl (3-chloro-2-fluoro-5-((2-methoxyethyl)(methyl)amino)benzyl)carbamate to produce 3-(aminomethyl)-5-chloro-4-fluoro-N-(2-methoxyethyl)-N-methylaniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1", "CO"], "agent": ["Cl"]} |
Using 5-methylspiro[thiochromane-4,2'-[1,3]dioxolane]-6-carboxylic acid 1,1-dioxide to produce 5-methyl-4-oxothiochromane-6-carboxylic acid 1,1-dioxide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CC(C)=O"], "agent": ["Cl"]} |
Using N-(5-fluoro-2-sulfamoylbenzyl)acetamide to produce 2-(aminomethyl)-4-fluorobenzenesulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["Cl"]} |
Using (4-(((2S,3R)-3-hydroxy-5-(pyridin-3-yl)pentan-2-yl)oxy)phenyl)boronic acid, 1-(4-bromophenyl)urea to produce 1-(4'-(((2S,3R)-3-hydroxy-5-(pyridin-3-yl)pentan-2-yl)oxy)-[1,1'-biphenyl]-4-yl)urea, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["O=C([O-])[O-]", "[Na+]", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using tert-butyl (4-(2-(4-(2-bromo-5-methoxybenzyl)piperidin-1-yl)ethyl)phenyl)carbamate to produce 4-(2-(4-(2-bromo-5-methoxybenzyl)piperidin-1-yl)ethyl)aniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["Cl"]} |
Using 1-cyclohexyl-3-((3,5-dichloro-4'-(piperazine-1-carbonyl)-[1,1'-biphenyl]-4-yl)methyl)pyrrolidin-2-one, acetylchloride to produce 3-((4'-(4-acetylpiperazine-1-carbonyl)-3,5-dichloro-[1,1'-biphenyl]-4-yl)methyl)-1-cyclohexylpyrrolidin-2-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl"], "agent": ["[Na+]", "[OH-]"]} |
Using 4-amino-3-nitrophenol to produce 3,4-diaminophenol, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CO"], "agent": ["[Pd]"]} |
Using ethanol, 3-((4-((2-(4-(butoxycarbonyl)piperazin-1-yl)-2-oxoethyl)carbamoyl)-2-phenylthiazol-5-yl)amino)propanoic acid to produce butyl 4-((5-((3-ethoxy-3-oxopropyl)amino)-2-phenylthiazole-4-carbonyl)glycyl)piperazine-1-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O"], "agent": ["O=S(=O)(O)O"]} |
Using methyl (2-(3-nitrophenyl)acetyl)-L-alaninate to produce (2-(3-nitrophenyl)acetyl)-L-alanine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1", "O"], "agent": ["[Li+]", "[OH-]"]} |
Using ethyl 2-(2-(3-chlorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl)acetate to produce 2-(2-(3-chlorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl)acetic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO", "O"], "agent": ["[Na+]", "[OH-]"]} |
Using hydrogen carbonate, 5-amino-2-methoxy-[1,1'-biphenyl]-4-carboxylic acid to produce methyl 5-amino-2-methoxy-[1,1'-biphenyl]-4-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClC(Cl)Cl", "CO"], "agent": ["O=S(=O)(O)O", "[Na+]"]} |
Using N-(4-chlorophenyl)-N-((2S,4R)-1-(4-methoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)acetamide to produce N-((2S,4R)-1-(4-methoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylacetamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CO"], "agent": ["[Pd]"]} |
Using 2-methyl-2H-thieno[3,2-e][1,2]thiazin-3(4H)-one 1,1-dioxide, 1-isocyanato-2-methyl-4-nitrobenzene to produce 3-hydroxy-2-methyl-N-(2-methyl-4-nitrophenyl)-2H-thieno[3,2-e][1,2]thiazine-4-carboxamide 1,1-dioxide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CS(C)=O", "CCN(CC)CC"], "agent": ["Cl"]} |
Using 1-(2-chloroethyl)pyrrolidine, 2,2,2-trifluoro-1-(1-(4-hydroxyphenyl)-6-methoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one to produce 2,2,2-trifluoro-1-(6-methoxy-1-(4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "O"], "agent": ["[Na+]", "Cl", "[H-]"]} |
Using iodomethane, ethyl 5-hydroxy-11-methyl-1,2,4,5-tetrahydro-3H-azepino[4,5-b]quinoline-3-carboxylate to produce ethyl 5-methoxy-11-methyl-1,2,4,5-tetrahydro-3H-azepino[4,5-b]quinoline-3-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "[Na]", "[H-]"]} |
Using 4-chloro-2-fluoro-1-nitrobenzene, aniline to produce 5-chloro-2-nitro-N-phenylaniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CS(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using 1-(4-(3-hydroxyprop-1-yn-1-yl)-2,3-dimethylphenyl)ethan-1-one to produce 1-(4-ethynylphenyl)ethan-1-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["Cc1ccccc1"], "agent": ["[Na+]", "[OH-]"]} |
Using aceticanhydride, 1-fluoro-5-nitronaphthalene to produce N-(5-fluoronaphthalen-1-yl)acetamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC(=O)O"], "agent": ["[Fe]"]} |
Using tetradecyl (S)-prolylglycinate, tert-butyl ((S)-1-((S)-2-carbamoylpyrrolidin-1-yl)-1-oxo-3-(thiazol-4-yl)propan-2-yl)carbamate to produce tetradecyl ((S)-2-((tert-butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoyl)-L-prolylglycinate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["On1nnc2ccccc21", "C(=NC1CCCCC1)=NC1CCCCC1"]} |
Using 3-benzyl-1,2,4-oxadiazol-5-amine, carbon dioxide to produce 2-(5-amino-1,2,4-oxadiazol-3-yl)-2-phenylacetic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCCCCC", "C1CCOC1"], "agent": ["[Li]CCCC"]} |
Using glycol, 1-(4-aminophenyl)ethan-1-one to produce 4-(2-methyl-1,3-dioxolan-2-yl)aniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "Cc1ccccc1"], "agent": ["Cc1ccc(S(=O)(=O)O)cc1"]} |
Using 3-(3-(N-(2-acetoxyethyl)-2,2-dimethyl-1,3-dioxolane-4-carboxamido)-5-(acetoxymethyl)-2,4,6-triiodobenzamido)propane-1,2-diyl diacetate to produce 3-(2,3-dihydroxy-N-(2-hydroxyethyl)propanamido)-N-(2,3-dihydroxypropyl)-5-(hydroxymethyl)-2,4,6-triiodobenzamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CO"], "agent": ["[Na+]", "[OH-]"]} |
Using tert-butyl (3-fluoro-4-hydroxyphenyl)carbamate, 4-chloropyridine-2,6-dicarboxamide to produce tert-butyl (4-((2,6-dicarbamoylpyridin-4-yl)oxy)-3-fluorophenyl)carbamate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["CC(C)(C)[O-]", "O=C([O-])[O-]", "[K+]"]} |
Using (3-nitrophenyl)hydrazine, ethyl 2-oxopropanoate to produce ethyl (E)-2-(2-(3-nitrophenyl)hydrazineylidene)propanoate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO"], "agent": ["Cl"]} |
Using 1-benzhydrylpiperazine, N-([1,2,4]triazolo[1,5-b]pyridazin-6-yl)-2-bromoacetamide to produce N-([1,2,4]triazolo[1,5-b]pyridazin-6-yl)-2-(4-benzhydrylpiperazin-1-yl)acetamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC#N", "CCOC(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using iodomethane, N-(2-((5-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)pyridin-3-yl)oxy)ethyl)ethanesulfonamide to produce N-methyl-N-(2-((5-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)pyridin-3-yl)oxy)ethyl)ethanesulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]", "[H-]"]} |
Using (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid, (9H-fluoren-9-yl)methyl (2,5-dioxopyrrolidin-1-yl) carbonate to produce (2S,4R)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["O=C([O-])[O-]", "[Na+]"]} |
Using 2-(naphthalen-1-yl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylic acid to produce 2-(naphthalen-1-yl)pyrazolo[1,5-a]pyrimidin-7(4H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CS(C)=O"], "agent": ["[Cl-]", "[Na+]"]} |
Using (tert-butoxycarbonyl)proline, 4-aminobenzonitrile to produce tert-butyl 2-((4-cyanophenyl)carbamoyl)pyrrolidine-1-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCOCC", "c1ccncc1"], "agent": ["O=C(Cl)C(=O)Cl"]} |
Using 4-methylbenzenesulfinate, methyl 4-(4-(chloromethyl)thiazol-2-yl)benzoate to produce methyl 4-(4-(tosylmethyl)thiazol-2-yl)benzoate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]"]} |
Using triethylborane, 2-(3-bromo-4-methoxyphenyl)acetonitrile to produce 2-(3-ethyl-4-methoxyphenyl)acetonitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using 5-(5-methoxy-2-nitrobenzylidene)imidazolidine-2,4-dione to produce 7-methoxy-1,3-dihydro-2H-imidazo[4,5-b]quinolin-2-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "CO"], "agent": ["[Pd]", "II"]} |
Using tert-butyl 4-(5-(trifluoromethyl)pyridin-3-yl)piperazine-1-carboxylate to produce 1-(5-(trifluoromethyl)pyridin-3-yl)piperazine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["Cl"]} |
Using 1-bromopyrrolidine-2,5-dione, 2-ethylquinazoline to produce 2-(bromomethyl)quinazoline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClC(Cl)Cl"], "agent": ["O=C(OOC(=O)c1ccccc1)c1ccccc1"]} |
Using 2-((tert-butyldimethylsilyl)oxy)ethan-1-ol, ethyl (S)-3-(4-(3-(4-(4-hydroxybenzoyl)phenoxy)propoxy)phenyl)-2-methoxypropanoate to produce ethyl (S)-3-(4-(3-(4-(4-(2-((tert-butyldimethylsilyl)oxy)ethoxy)benzoyl)phenoxy)propoxy)phenyl)-2-methoxypropanoate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["Cc1ccccc1"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1", "CC(C)OC(=O)N=NC(=O)OC(C)C"]} |
Using benzaldehyde, acetone to produce 1,5-diphenylpenta-1,4-dien-3-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO", "O"], "agent": ["[Na+]", "[OH-]"]} |
Using 4-(3-(1H-imidazol-1-yl)propyl)phenol, 4-(chloromethyl)-2-(5-methylthiophen-2-yl)oxazole to produce 4-((4-(3-(1H-imidazol-1-yl)propyl)phenoxy)methyl)-2-(5-methylthiophen-2-yl)oxazole, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using 1-methylcyclopenta-1,3-diene, (3-chloropropyl)dimethoxy(methyl)silane to produce dimethoxy(methyl)(3-(3-methylcyclopenta-2,4-dien-1-yl)propyl)silane, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCOCC"], "agent": ["[Na+]", "[H-]"]} |
Using indoline-2-carboxamide to produce indolin-2-ylmethanamine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Al+3]", "[Li+]", "[H-]"]} |
Using 5-(trifluoromethyl)benzene-1,3-diamine, 4-chlorobutanoic acid to produce N-(3-amino-5-(trifluoromethyl)phenyl)-4-chlorobutanamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "CCN(C(C)C)C(C)C"], "agent": ["On1nnc2ccccc21"]} |
Using 4-amino-N-(5-bromopyridin-2-yl)-3-nitrobenzamide to produce 3,4-diamino-N-(5-bromopyridin-2-yl)benzamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Ni]"]} |
Using 4,4-dimethyl-3,6-dioxabicyclo[3.1.0]hexan-2-one to produce 4-hydroxy-5,5-dimethyldihydrofuran-2(3H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[H][H]", "[Pd]"]} |
Using 3-(benzyloxy)-N-(cyclohexylmethyl)-1-cyclopropyl-6-methyl-4-oxo-1,4-dihydropyridine-2-carboxamide to produce N-(cyclohexylmethyl)-1-cyclopropyl-3-hydroxy-6-methyl-4-oxo-1,4-dihydropyridine-2-carboxamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO", "CO"], "agent": ["[H][H]", "[Pd]"]} |
Using 5-bromo-4-chloropyrimidine, piperidine-4-carboxamide to produce 1-(5-bromopyrimidin-4-yl)piperidine-4-carboxamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "CCN(CC)CC"], "agent": ["[Na+]", "Cl", "O=C([O-])O"]} |
Using ethyl 2-ethyl-4-(hydroxyimino)-6,8-dimethyl-3,4-dihydro-1,7-naphthyridine-1(2H)-carboxylate to produce ethyl 4-amino-2-ethyl-6,8-dimethyl-3,4-dihydro-1,7-naphthyridine-1(2H)-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC(=O)O"], "agent": ["[Zn]"]} |
Using 2-(1H-imidazol-4-yl)ethan-1-amine, 4-isopropylbenzaldehyde to produce 4-(4-isopropylphenyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["O", "CCO"], "agent": ["[K+]", "Cl", "[OH-]"]} |
Using dimethyl (S)-((2-aminopropanamido)methyl)phosphonate, ((benzyloxy)carbonyl)-L-alanine to produce benzyl ((S)-1-(((S)-1-(((dimethoxyphosphoryl)methyl)amino)-1-oxopropan-2-yl)amino)-1-oxopropan-2-yl)carbamate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O", "CCN(CC)CC"], "agent": ["Cl"]} |
Using 2-(9,10-ethanoanthracen-9(10H)-yl)acetyl chloride, quinoline to produce 3-(9,10-ethanoanthracen-9(10H)-yl)-2-hydroxypropanenitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["Cc1ccccc1C"], "agent": ["[S]", "[H][H]", "[Pd]"]} |
Using tert-butyl (Z)-4-((6-((1H-indazol-3-yl)methylene)-7-oxo-6,7-dihydro-[1,3]dioxolo[4,5-f]benzofuran-4-yl)methyl)piperazine-1-carboxylate to produce (Z)-6-((1H-indazol-3-yl)methylene)-4-(piperazin-1-ylmethyl)-[1,3]dioxolo[4,5-f]benzofuran-7(6H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1", "ClCCl"], "agent": ["Cl"]} |
Using 1,8-dimethyl-9-nitro-3,5-dihydrobenzo[5,6][1,4]oxazino[3,4-c][1,2,4]triazin-2(1H)-one to produce 9-amino-1,8-dimethyl-3,5-dihydrobenzo[5,6][1,4]oxazino[3,4-c][1,2,4]triazin-2(1H)-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Cl-]", "[NH4+]", "[Zn]"]} |
Using 2-mercapto-3-methylthieno[3,2-d]pyrimidin-4(3H)-one, 4-(4-(bromomethyl)benzoyl)phenyl acetate to produce 4-(4-(((3-methyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)thio)methyl)benzoyl)phenyl acetate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCO", "O"], "agent": ["[Na+]", "[OH-]"]} |
Using N-((2-((R)-2-((1r,4R)-4-(2-(benzyloxy)ethyl)cyclohexyl)pyrrolidin-1-yl)-6,7-difluoroquinolin-3-yl)methyl)-N-(3,5-bis(trifluoromethyl)benzyl)-2-methyl-2H-tetrazol-5-amine to produce 2-((1R,4r)-4-((R)-1-(3-(((3,5-bis(trifluoromethyl)benzyl)(2-methyl-2H-tetrazol-5-yl)amino)methyl)-6,7-difluoroquinolin-2-yl)pyrrolidin-2-yl)cyclohexyl)ethan-1-ol, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl"], "agent": ["BrB(Br)Br"]} |
Using tert-butyl piperidin-4-ylcarbamate, 2-hydroxyacetic acid to produce tert-butyl (1-(2-hydroxyacetyl)piperidin-4-yl)carbamate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "CCN(CC)CC"], "agent": ["On1nnc2ccccc21", "Cl"]} |
Using 4-(2-aminophenyl)-N,N-bis(4-methoxybenzyl)-6-methyl-1,3,5-triazin-2-amine, (6-methoxypyridin-3-yl)boronic acid to produce N,N-bis(4-methoxybenzyl)-4-(2-((6-methoxypyridin-3-yl)amino)phenyl)-6-methyl-1,3,5-triazin-2-amine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl", "CCN(C(C)C)C(C)C"], "agent": ["[Cu+2]", "CC(=O)[O-]"]} |
Using N-(3-(N-(2,6-dichlorophenyl)sulfamoyl)-1H-1,2,4-triazol-5-yl)acetamide to produce 5-amino-N-(2,6-dichlorophenyl)-1H-1,2,4-triazole-3-sulfonamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["Cl"]} |
Using 2,3-dihydro-1H-inden-2-amine, 2,2,2-trichloro-1-(10-(2-methoxy-2'-methyl-[1,1'-biphenyl]-4-carbonyl)-10,11-dihydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-3-yl)ethan-1-one to produce N-(2,3-dihydro-1H-inden-2-yl)-10-(2-methoxy-2'-methyl-[1,1'-biphenyl]-4-carbonyl)-10,11-dihydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-3-carboxamide, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCN(CC)CC"], "agent": ["Cl"]} |
Using 1-(pyrrolidin-3-yl)-1H-1,2,3-triazole, (S)-9,10-difluoro-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid to produce (3S)-10-(3-(1H-1,2,3-triazol-1-yl)pyrrolidin-1-yl)-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC#N", "C1CCC2=NCCCN2CC1"], "agent": ["Cl"]} |
Using propyl 11-(1-cyanoethylidene)-3-fluoro-6,11-dihydrodibenzo[b,e]oxepine-8-carboxylate to produce (E)-2-(3-fluoro-8-(hydroxymethyl)dibenzo[b,e]oxepin-11(6H)-ylidene)propanenitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Li+]", "Cl", "[BH4-]"]} |
Using 1,3-dichloro-2-(4-((4-chlorophenyl)sulfonyl)phenoxy)-5-nitrobenzene to produce 3,5-dichloro-4-(4-((4-chlorophenyl)sulfonyl)phenoxy)aniline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["[Na+]", "Cl", "[OH-]"]} |
Using 3-(2-(2-(cyclohexylmethyl)piperidin-1-yl)ethyl)-5-methoxy-2-methyl-1H-indole, 2-methoxybenzoyl chloride to produce (3-(2-(2-(cyclohexylmethyl)piperidin-1-yl)ethyl)-5-methoxy-2-methyl-1H-indol-1-yl)(2-methoxyphenyl)methanone, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]", "[Na]", "[H-]"]} |
Using 2-(4-chlorophenyl)-1-(4-fluoro-2-hydroxyphenyl)-4-methylpentane-1,3-dione to produce 3-(4-chlorophenyl)-7-fluoro-2-isopropyl-4H-chromen-4-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCOC(C)=O", "CC(=O)O"], "agent": ["[NH4+]", "Cl", "[OH-]"]} |
Using 3-(4-(benzhydryloxy)piperidin-1-yl)propan-1-ol, 6-chloro-2-methyl-[1,2,4]triazolo[1,5-b]pyridazine to produce 6-(3-(4-(benzhydryloxy)piperidin-1-yl)propoxy)-2-methyl-[1,2,4]triazolo[1,5-b]pyridazine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["CC(C)(C)[O-]", "[Na+]"]} |
Using methyl 7-((1R,2R,3R,5S)-5-acetoxy-2-formyl-3-((tetrahydro-2H-pyran-2-yl)oxy)cyclopentyl)heptanoate, dimethyl (3,3-difluoro-2-oxoheptyl)phosphonate to produce methyl 7-((1R,2R,3R,5S)-5-acetoxy-2-((E)-4,4-difluoro-3-oxooct-1-en-1-yl)-3-((tetrahydro-2H-pyran-2-yl)oxy)cyclopentyl)heptanoate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "[H-]"]} |
Using 2-(trimethylsilyl)ethyl (2-((1-(4-cyano-2-fluorophenyl)-7-methoxy-3-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-8-yl)oxy)-2-(thiophen-2-yl)ethyl)carbamate to produce 4-(8-(2-amino-1-(thiophen-2-yl)ethoxy)-7-methoxy-3-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)-3-fluorobenzonitrile, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CS(C)=O"], "agent": ["[F-]", "[Cs+]"]} |
Using 1-methylpiperidin-4-amine, 4-fluoro-2-isopropoxy-1-nitrobenzene to produce N-(3-isopropoxy-4-nitrophenyl)-1-methylpiperidin-4-amine, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CCOC(C)=O", "CS(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using fluorobenzene, 1-(2-phenylquinazolin-4-yl)piperidin-4-ol to produce 4-(4-phenoxypiperidin-1-yl)-2-phenylquinazoline, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]", "[H-]"]} |
Using 2-chloro-3-(2-((tetrahydro-2H-pyran-2-yl)oxy)ethoxy)pyridine, (S)-(1-methylpyrrolidin-2-yl)methanol to produce (S)-2-((2-((1-methylpyrrolidin-2-yl)methoxy)pyridin-3-yl)oxy)ethan-1-ol, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["Cc1ccccc1", "CC(C)(C)O"], "agent": ["CC(C)(C)[O-]", "[K+]"]} |
Using 1-((4bR,8aR,9R)-6,7,8,8a,9,10-hexahydro-5H-9,4b-(epiminoethano)phenanthren-3-yl)ethan-1-one, (chloromethyl)cyclopropane to produce 1-((4bR,8aR,9R)-11-(cyclopropylmethyl)-6,7,8,8a,9,10-hexahydro-5H-9,4b-(epiminoethano)phenanthren-3-yl)ethan-1-one, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]", "O=C([O-])O"]} |
Using methyl 3-methyl-4-(((R)-1-phenylethyl)imino)tetrahydro-2H-pyran-3-carboxylate to produce methyl (4R)-3-methyl-4-(((R)-1-phenylethyl)amino)tetrahydro-2H-pyran-3-carboxylate, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["CC#N", "CC(=O)O"], "agent": ["CC(=O)O[BH-](OC(C)=O)OC(C)=O", "[Na+]"]} |
Using azetidin-1-yl(3-fluoro-4-(3-(((S)-1-methoxypropan-2-yl)oxy)-5-(5-((S)-5-methyl-4,5-dihydrooxazol-2-yl)-1H-pyrrol-2-yl)phenoxy)phenyl)methanone to produce azetidin-1-yl(3-fluoro-4-(3-(((S)-1-hydroxypropan-2-yl)oxy)-5-(5-((S)-5-methyl-4,5-dihydrooxazol-2-yl)-1H-pyrrol-2-yl)phenoxy)phenyl)methanone, please predict the condition, including solvent and agent in SMILES notation in json format like:
```JSON
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": [
"On1nnc2ccccc21",
"C(=NC1CCCCC1)=NC1CCCCC1",
"Cl"
]
}
```
| {"solvent": ["ClCCl"], "agent": ["[Na+]", "O=C([O-])O", "BrB(Br)Br"]} |
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