molecule_smiles
stringlengths 1
2.5k
| SELFIES
stringlengths 3
9.88k
|
|---|---|
Cc1cccc(OC(C)CCNC2CC2)c1C | [C][C][=C][C][=C][C][Branch1][=C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1][=C][Ring1][#C][C] |
CCc1ccc(OC(C)CCNC2CC2)cc1 | [C][C][C][=C][C][=C][Branch1][=C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1][C][=C][Ring1][#C] |
c1ccc(CCOCCCC2CCCN2)cc1 | [C][=C][C][=C][Branch1][=C][C][C][O][C][C][C][C][C][C][C][N][Ring1][Branch1][C][=C][Ring1][P] |
CCc1cccc(OC(C)CCNC2CC2)c1 | [C][C][C][=C][C][=C][C][Branch1][=C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1][=C][Ring1][#C] |
CCNC1CCCC1OCCc1ccccc1 | [C][C][N][C][C][C][C][C][Ring1][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CCOCC(C)NC1(C(=O)O)CCSC1 | [C][C][O][C][C][Branch1][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][S][C][Ring1][Branch2] |
CCc1ccccc1OC(C)CCNC1CC1 | [C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1] |
COCC(C)(Nc1cccc(C#N)c1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][=Branch1][C][=O][O] |
C=CCc1ccccc1OC(C)CCNCC | [C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][N][C][C] |
CCOC(=O)CSc1cnnc(Cl)n1 | [C][C][O][C][=Branch1][C][=O][C][S][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CCOCC(C)NC(C)(CCOC)C(=O)O | [C][C][O][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][O] |
COC(=O)CCSc1cnnc(Cl)n1 | [C][O][C][=Branch1][C][=O][C][C][S][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CC1(C)CC1Nc1c(O)[nH]c2ccc(F)cc12 | [C][C][Branch1][C][C][C][C][Ring1][Ring2][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][O][Ring1][#Branch1] |
CNC(=O)C(C)Nc1c(O)[nH]c2ccccc12 | [C][N][C][=Branch1][C][=O][C][Branch1][C][C][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
COCC(C)(Nc1ccccc1C#N)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][N][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N][C][=Branch1][C][=O][O] |
CCOC(=O)CNc1c(O)[nH]c2ccccc12 | [C][C][O][C][=Branch1][C][=O][C][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
NC(=O)c1ccc(CS(=O)(=O)Cl)cc1 | [N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][C][S][=Branch1][C][=O][=Branch1][C][=O][Cl][C][=C][Ring1][O] |
COCC(C)(Nc1ccc(C#N)cc1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][=Branch1][C][=O][O] |
CC=CCOC(C)(C(=O)O)c1ccccc1C | [C][C][=C][C][O][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C] |
Cc1ccc(OC(C)CCNC2CC2)cc1C | [C][C][=C][C][=C][Branch1][=C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1][C][=C][Ring1][#C][C] |
COCCC(C)(OCCOC(C)C)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][#Branch2][O][C][C][O][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
COCC(C)(C(=O)O)N(C)C1CCSC1 | [C][O][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][C][C][S][C][Ring1][Branch1] |
CCNCCC(C)Oc1ccc2c(c1)CCC2 | [C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1] |
CC(NC1CC1(C)C)(C(=O)O)c1ccccn1 | [C][C][Branch1][O][N][C][C][C][Ring1][Ring1][Branch1][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=N][Ring1][=Branch1] |
CC(C(=O)O)(c1ccccc1)N1CCC(N)C1 | [C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1] |
NCCCNC1(C(=O)O)Cc2ccccc2C1 | [N][C][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N] |
NCCCNC1(C(=O)O)CCc2ccccc21 | [N][C][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] |
CC=CCOC(C)(C(=O)O)c1cccc(C)c1 | [C][C][=C][C][O][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] |
CC1(C)CC1Nc1c(O)[nH]c2cc(F)ccc12 | [C][C][Branch1][C][C][C][C][Ring1][Ring2][N][C][=C][Branch1][C][O][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][O][Ring1][#Branch1] |
Cc1cc(C)c(OCC(C)C#N)c([N+](=O)[O-])c1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][=Branch2][O][C][C][Branch1][C][C][C][#N][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][S] |
COCCCCNc1c(O)[nH]c2ccccc12 | [C][O][C][C][C][C][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
CC=CCOC(CC)(C(=O)O)c1ccccc1 | [C][C][=C][C][O][C][Branch1][Ring1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1] |
Cc1ccc(C)c(OC(C)CCNC2CC2)c1 | [C][C][=C][C][=C][Branch1][C][C][C][Branch1][=C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1][=C][Ring1][S] |
CC(c1ccc(N(C)C)cc1)S(N)(=O)=O | [C][C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O] |
CCOCC(C)Nc1c(O)[nH]c2ccccc12 | [C][C][O][C][C][Branch1][C][C][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
Nc1c(O)n(CCCCCO)c2ccccc12 | [N][C][=C][Branch1][C][O][N][Branch1][#Branch1][C][C][C][C][C][O][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1] |
CC(CNC1(C(=O)O)CCCCC1)N(C)C | [C][C][Branch2][Ring1][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][Ring1][=Branch2][N][Branch1][C][C][C] |
Cc1nc(N)c(NC2CC2c2ccccc2)[nH]1 | [C][C][=N][C][Branch1][C][N][=C][Branch1][#C][N][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][S] |
CCN1CCC(CNC(C)(C)C(=O)O)CC1 | [C][C][N][C][C][C][Branch1][#C][C][N][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Ring1][=C] |
CCN(c1cccc(F)c1)c1[nH]c(C)nc1N | [C][C][N][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][NH1][C][Branch1][C][C][=N][C][=Ring1][=Branch1][N] |
CC=CCOC(CC)(CC(C)CC)C(=O)O | [C][C][=C][C][O][C][Branch1][Ring1][C][C][Branch1][Branch2][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O] |
Cc1nc(N)c(NC(C)c2cc(C)oc2C)[nH]1 | [C][C][=N][C][Branch1][C][N][=C][Branch1][P][N][C][Branch1][C][C][C][C][=C][Branch1][C][C][O][C][=Ring1][=Branch1][C][NH1][Ring1][S] |
CC(NC1CC1(C)C)(C(=O)O)c1ccncc1 | [C][C][Branch1][O][N][C][C][C][Ring1][Ring1][Branch1][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=N][C][=C][Ring1][=Branch1] |
CCC(C)(NCC1CCN(C)CC1)C(=O)O | [C][C][C][Branch1][C][C][Branch1][=C][N][C][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][O] |
CC(C)N1CCC(CNC(C)(C)C(=O)O)C1 | [C][C][Branch1][C][C][N][C][C][C][Branch1][#C][C][N][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][Ring1][=N] |
CCCC(CCC)(C(=O)O)N1CCC(N)C1 | [C][C][C][C][Branch1][Ring2][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1] |
CC(CNC(C)C)COCCN1CCCC1 | [C][C][Branch1][Branch2][C][N][C][Branch1][C][C][C][C][O][C][C][N][C][C][C][C][Ring1][Branch1] |
CCC(C)(NCC1CCCCN1C)C(=O)O | [C][C][C][Branch1][C][C][Branch1][N][N][C][C][C][C][C][C][N][Ring1][=Branch1][C][C][=Branch1][C][=O][O] |
CCNCC(C)COCCN1CCCCC1 | [C][C][N][C][C][Branch1][C][C][C][O][C][C][N][C][C][C][C][C][Ring1][=Branch1] |
CCC(C)(NCC1CCCN(C)C1)C(=O)O | [C][C][C][Branch1][C][C][Branch1][=C][N][C][C][C][C][C][N][Branch1][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][O] |
NCCCNC1(C(=O)O)CCCCCCC1 | [N][C][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][C][C][Ring1][O] |
CCCNCC(C)COCCN1CCCC1 | [C][C][C][N][C][C][Branch1][C][C][C][O][C][C][N][C][C][C][C][Ring1][Branch1] |
CCCNCCC(C)OCCN1CCCC1 | [C][C][C][N][C][C][C][Branch1][C][C][O][C][C][N][C][C][C][C][Ring1][Branch1] |
CC(NC1CC1(C)C)(C(=O)O)c1cccnc1 | [C][C][Branch1][O][N][C][C][C][Ring1][Ring1][Branch1][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][N][=C][Ring1][=Branch1] |
CC(C)NCCC(C)OCCN1CCCC1 | [C][C][Branch1][C][C][N][C][C][C][Branch1][C][C][O][C][C][N][C][C][C][C][Ring1][Branch1] |
CCC1CCC(NCCCN)(C(=O)O)CC1 | [C][C][C][C][C][C][Branch1][=Branch1][N][C][C][C][N][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][=C] |
CCN(CC)CCOCC(C)CNC1CC1 | [C][C][N][Branch1][Ring1][C][C][C][C][O][C][C][Branch1][C][C][C][N][C][C][C][Ring1][Ring1] |
OCC1CCN(c2cnnc(Cl)n2)CC1 | [O][C][C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][Ring1][=N] |
CC(C)CCC(C)(C(=O)O)N1CCC(N)C1 | [C][C][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1] |
Cc1n[nH]c(Sc2cnnc(Cl)n2)n1 | [C][C][=N][NH1][C][Branch1][=N][S][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][=N][Ring1][=N] |
Clc1nncc(OCCN2CCCC2)n1 | [Cl][C][=N][N][=C][C][Branch1][O][O][C][C][N][C][C][C][C][Ring1][Branch1][=N][Ring1][=C] |
Cn1cnnc1Sc1cnnc(Cl)n1 | [C][N][C][=N][N][=C][Ring1][Branch1][S][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CC1CN(c2cnnc(Cl)n2)CC(C)O1 | [C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][Branch1][C][C][O][Ring1][=C] |
CCNCCC(C)OCCC1CCCN1C | [C][C][N][C][C][C][Branch1][C][C][O][C][C][C][C][C][C][N][Ring1][Branch1][C] |
CCNCC(C)COCCC1CCCN1C | [C][C][N][C][C][Branch1][C][C][C][O][C][C][C][C][C][C][N][Ring1][Branch1][C] |
CC(CNC(C)(C)C(=O)O)N1CCCCC1 | [C][C][Branch1][#C][C][N][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][N][C][C][C][C][C][Ring1][=Branch1] |
CC1(C)COCCN1c1cnnc(Cl)n1 | [C][C][Branch1][C][C][C][O][C][C][N][Ring1][#Branch1][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CC=CCOC(C)(C(=O)O)c1ccc(C)cc1 | [C][C][=C][C][O][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1] |
CCN(CC)CCOC(C)CCNC1CC1 | [C][C][N][Branch1][Ring1][C][C][C][C][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1] |
CN(CC1CCCO1)c1cnnc(Cl)n1 | [C][N][Branch1][=Branch2][C][C][C][C][C][O][Ring1][Branch1][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CCC1CN(c2cnnc(Cl)n2)CCO1 | [C][C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][O][Ring1][=N] |
OCC1CCCN(c2cnnc(Cl)n2)C1 | [O][C][C][C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][Ring1][=N] |
CC(C)CC(C)(C(=O)O)N1CCC(CN)C1 | [C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][C][Branch1][Ring1][C][N][C][Ring1][#Branch1] |
OCC1CCCCN1c1cnnc(Cl)n1 | [O][C][C][C][C][C][C][N][Ring1][=Branch1][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
COCCC(C)(C(=O)O)n1c(O)ccc1O | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][Branch1][C][O][=C][C][=C][Ring1][=Branch1][O] |
CC1(C)CN(c2cnnc(Cl)n2)CCO1 | [C][C][Branch1][C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][O][Ring1][=C] |
CC(C)CN(c1cnnc(Cl)n1)C(C)C | [C][C][Branch1][C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][Branch1][C][C][C] |
COCCN(c1cnnc(Cl)n1)C1CC1 | [C][O][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][C][Ring1][Ring1] |
Cc1cc(Nc2cccnn2)ccc1C(=O)O | [C][C][=C][C][Branch1][#Branch2][N][C][=C][C][=C][N][=N][Ring1][=Branch1][=C][C][=C][Ring1][=N][C][=Branch1][C][=O][O] |
O=C(O)c1ccc(CNc2cccnn2)cc1 | [O][=C][Branch1][C][O][C][=C][C][=C][Branch1][O][C][N][C][=C][C][=C][N][=N][Ring1][=Branch1][C][=C][Ring1][=C] |
CC1CN(c2cnnc(Cl)n2)C(C)CO1 | [C][C][C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][Branch1][C][C][C][O][Ring1][=C] |
Clc1nncc(NCCC2CCCO2)n1 | [Cl][C][=N][N][=C][C][Branch1][O][N][C][C][C][C][C][C][O][Ring1][Branch1][=N][Ring1][=C] |
CC(N(C)c1cnnc(Cl)n1)C(C)(C)C | [C][C][Branch1][S][N][Branch1][C][C][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][C] |
CCNCCC(C)Oc1ccc(F)cc1F | [C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
CN1CCC(Oc2cnnc(Cl)n2)CC1 | [C][N][C][C][C][Branch1][=N][O][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][Ring1][=C] |
COCCC(C)(C(=O)O)N1CCCCC1=O | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][C][C][C][Ring1][=Branch1][=O] |
CCNCCC(C)Oc1ccc(F)c(F)c1 | [C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
CCc1c[nH]c(C2CNc3ccccc3O2)n1 | [C][C][C][=C][NH1][C][Branch1][#C][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2][=N][Ring1][#C] |
OCc1cccc(OCCc2ccccc2)n1 | [O][C][C][=C][C][=C][C][Branch1][N][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][#C] |
CC=CCOC(C)(CCCCCC)C(=O)O | [C][C][=C][C][O][C][Branch1][C][C][Branch1][#Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][O] |
CC(C)Oc1ccccc1CS(N)(=O)=O | [C][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][S][Branch1][C][N][=Branch1][C][=O][=O] |
CCCOc1cccc(CS(N)(=O)=O)c1 | [C][C][C][O][C][=C][C][=C][C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Ring1][O] |
CC(C)CC(C)N(C)c1cnnc(Cl)n1 | [C][C][Branch1][C][C][C][C][Branch1][C][C][N][Branch1][C][C][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CC(C)Oc1ccc(CS(N)(=O)=O)cc1 | [C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][O] |
O=C(O)C(Nc1cccnn1)c1ccccc1 | [O][=C][Branch1][C][O][C][Branch1][#Branch2][N][C][=C][C][=C][N][=N][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CCC(c1ccc(OC)cc1)S(N)(=O)=O | [C][C][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][S][Branch1][C][N][=Branch1][C][=O][=O] |
COCC(C)(NCc1nc(C)no1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=N][N][C][C][=N][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][=Branch1][C][=O][O] |
CC(C)Oc1cccc(CS(N)(=O)=O)c1 | [C][C][Branch1][C][C][O][C][=C][C][=C][C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Ring1][O] |
CN(c1cnnc(Cl)n1)C1CCOCC1 | [C][N][Branch1][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][C][O][C][C][Ring1][=Branch1] |
CCOc1ccc(C(C)S(N)(=O)=O)cc1 | [C][C][O][C][=C][C][=C][Branch1][=N][C][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][N] |
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