Product OPENEYE NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxo-ethyl]-2-oxo-4-quinolyl]acetic acid
CAS Name: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxoethyl]-2-oxo-4-quinolinyl]acetic acid
IUPAC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxoethyl]-2-oxoquinolin-4-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-quinolin-4-yl]ethanoic acid
MOLECULAR FORMULA: C27H29N5O4
MOLECULAR WEIGHT: 487.55026
SMILES: C1CC(CCC1CNC(=O)CN2C3=CC=CC=C3C(=CC2=O)CC(=O)O)NC4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: (2R)-N-[(1R)-1-[5-[5-chloro-3-fluoro-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-3-fluoro-2-pyridyl]ethyl]-3,3,3-trifluoro-2-hydroxy-2-methyl-propanamide
CAS Name: (2R)-N-[(1R)-1-[5-[5-chloro-3-fluoro-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-3-fluoro-2-pyridinyl]ethyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
IUPAC NAME: (2R)-N-[(1R)-1-[5-[5-chloro-3-fluoro-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-3-fluoropyridin-2-yl]ethyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
SYSTEMATIC NAME: (2R)-N-[(1R)-1-[5-[5-chloranyl-3-fluoranyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-3-fluoranyl-pyridin-2-yl]ethyl]-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanamide
MOLECULAR FORMULA: C20H16ClF5N4O3
MOLECULAR WEIGHT: 490.811056
SMILES: CC1=NOC(=N1)C2=C(C=C(C=C2C3=CC(=C(N=C3)[C@@H](C)NC(=O)[C@](C)(C(F)(F)F)O)F)Cl)F
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Product OPENEYE NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxo-ethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
CAS Name: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxoethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
IUPAC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxoethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-3,4-dihydroquinazolin-4-yl]ethanoic acid
MOLECULAR FORMULA: C26H30N6O4
MOLECULAR WEIGHT: 490.5542
SMILES: C1CC(CCC1CNC(=O)CN2C3=CC=CC=C3C(NC2=O)CC(=O)O)NC4=NC5=CC=CC=C5N4
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Product OPENEYE NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)phenyl]methylamino]-2-oxo-ethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
CAS Name: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)phenyl]methylamino]-2-oxoethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
IUPAC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)phenyl]methylamino]-2-oxoethyl]-2-oxo-3,4-dihydroquinazolin-4-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[2-[[4-(1H-benzimidazol-2-ylamino)phenyl]methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-3,4-dihydroquinazolin-4-yl]ethanoic acid
MOLECULAR FORMULA: C26H24N6O4
MOLECULAR WEIGHT: 484.50656
SMILES: C1=CC=C2C(=C1)C(NC(=O)N2CC(=O)NCC3=CC=C(C=C3)NC4=NC5=CC=CC=C5N4)CC(=O)O
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Product OPENEYE NAME: N-[5-(2,3-difluorophenyl)-1-methyl-2-oxo-3-pyridyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CAS Name: N-[5-(2,3-difluorophenyl)-1-methyl-2-oxo-3-pyridinyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-1-piperidinecarboxamide
IUPAC NAME: N-[5-(2,3-difluorophenyl)-1-methyl-2-oxopyridin-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
SYSTEMATIC NAME: N-[5-[2,3-bis(fluoranyl)phenyl]-1-methyl-2-oxidanylidene-pyridin-3-yl]-4-(2-oxidanylidene-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
MOLECULAR FORMULA: C24H22F2N6O3
MOLECULAR WEIGHT: 480.466686
SMILES: CN1C=C(C=C(C1=O)NC(=O)N2CCC(CC2)N3C4=C(NC3=O)N=CC=C4)C5=C(C(=CC=C5)F)F
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Product OPENEYE NAME: ethyl 4-[(5-chloro-1H-indole-2-carbonyl)amino]-3-[(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carbonyl)amino]piperidine-1-carboxylate
CAS Name: 4-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-3-[[(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[(5-chloro-1H-indole-2-carbonyl)amino]-3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carbonyl)amino]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbonylamino]piperidine-1-carboxylate
MOLECULAR FORMULA: C25H29ClN6O4S
MOLECULAR WEIGHT: 545.05356
SMILES: CCOC(=O)N1CCC(C(C1)NC(=O)C2=NC3=C(S2)CN(CC3)C)NC(=O)C4=CC5=C(N4)C=CC(=C5)Cl
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Product OPENEYE NAME: N-[5-(3-fluorophenyl)-1-methyl-2-oxo-3-pyridyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CAS Name: N-[5-(3-fluorophenyl)-1-methyl-2-oxo-3-pyridinyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)-1-piperidinecarboxamide
IUPAC NAME: N-[5-(3-fluorophenyl)-1-methyl-2-oxopyridin-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
SYSTEMATIC NAME: N-[5-(3-fluorophenyl)-1-methyl-2-oxidanylidene-pyridin-3-yl]-4-(2-oxidanylidene-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
MOLECULAR FORMULA: C24H23FN6O3
MOLECULAR WEIGHT: 462.476223
SMILES: CN1C=C(C=C(C1=O)NC(=O)N2CCC(CC2)N3C4=C(NC3=O)N=CC=C4)C5=CC(=CC=C5)F
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Product OPENEYE NAME: N-[3-[(5-chloro-1H-indole-2-carbonyl)amino]-1-methylsulfonyl-4-piperidyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
CAS Name: N-[3-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-1-methylsulfonyl-4-piperidinyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
IUPAC NAME: N-[3-[(5-chloro-1H-indole-2-carbonyl)amino]-1-methylsulfonylpiperidin-4-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[3-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-1-methylsulfonyl-piperidin-4-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
MOLECULAR FORMULA: C23H27ClN6O4S2
MOLECULAR WEIGHT: 551.08128
SMILES: CN1CCC2=C(C1)SC(=N2)C(=O)NC3CCN(CC3NC(=O)C4=CC5=C(N4)C=CC(=C5)Cl)S(=O)(=O)C
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Product OPENEYE NAME: N-[5-[(2,3-difluorophenyl)methylsulfanyl]-7-[[(1R)-2-hydroxy-1-methyl-ethyl]amino]thiazolo[4,5-d]pyrimidin-2-yl]methanesulfonamide
CAS Name: N-[5-[(2,3-difluorophenyl)methylthio]-7-[[(2R)-1-hydroxypropan-2-yl]amino]-2-thiazolo[4,5-d]pyrimidinyl]methanesulfonamide
IUPAC NAME: N-[5-[(2,3-difluorophenyl)methylsulfanyl]-7-[[(2R)-1-hydroxypropan-2-yl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-2-yl]methanesulfonamide
SYSTEMATIC NAME: N-[5-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-7-[[(2R)-1-oxidanylpropan-2-yl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-2-yl]methanesulfonamide
MOLECULAR FORMULA: C16H17F2N5O3S3
MOLECULAR WEIGHT: 461.529686
SMILES: C[C@H](CO)NC1=NC(=NC2=C1SC(=N2)NS(=O)(=O)C)SCC3=C(C(=CC=C3)F)F
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Product OPENEYE NAME: 4-[2-[(2R)-2-[(E,3S)-4-(3-chlorophenyl)-3-hydroxy-but-1-enyl]-5-oxo-pyrrolidin-1-yl]ethyl]benzoic acid
CAS Name: 4-[2-[(2R)-2-[(E,3S)-4-(3-chlorophenyl)-3-hydroxybut-1-enyl]-5-oxo-1-pyrrolidinyl]ethyl]benzoic acid
IUPAC NAME: 4-[2-[(2R)-2-[(E,3S)-4-(3-chlorophenyl)-3-hydroxybut-1-enyl]-5-oxopyrrolidin-1-yl]ethyl]benzoic acid
SYSTEMATIC NAME: 4-[2-[(2R)-2-[(E,3S)-4-(3-chlorophenyl)-3-oxidanyl-but-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid
MOLECULAR FORMULA: C23H24ClNO4
MOLECULAR WEIGHT: 413.89396
SMILES: C1CC(=O)N([C@H]1/C=C/[C@H](CC2=CC(=CC=C2)Cl)O)CCC3=CC=C(C=C3)C(=O)O
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Product OPENEYE NAME: (2S)-3-(4-phenylphenyl)-2-[(2-sulfanylacetyl)amino]propanoic acid
CAS Name: (2S)-2-[(2-mercapto-1-oxoethyl)amino]-3-(4-phenylphenyl)propanoic acid
IUPAC NAME: (2S)-3-(4-phenylphenyl)-2-[(2-sulfanylacetyl)amino]propanoic acid
SYSTEMATIC NAME: (2S)-3-(4-phenylphenyl)-2-(2-sulfanylethanoylamino)propanoic acid
MOLECULAR FORMULA: C17H17NO3S
MOLECULAR WEIGHT: 315.38678
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C[C@@H](C(=O)O)NC(=O)CS
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Product OPENEYE NAME: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3,3-dimethyl-butanamide
CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazinyl)phenyl]-3,3-dimethylbutanamide
IUPAC NAME: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3,3-dimethylbutanamide
SYSTEMATIC NAME: N-[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]-3,3-dimethyl-butanamide
MOLECULAR FORMULA: C18H28ClN3O
MOLECULAR WEIGHT: 337.88742
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CC(C)(C)C)Cl
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Product OPENEYE NAME: 2-benzyloxy-N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]acetamide
CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazinyl)phenyl]-2-phenylmethoxyacetamide
IUPAC NAME: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxyacetamide
SYSTEMATIC NAME: N-[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxy-ethanamide
MOLECULAR FORMULA: C21H26ClN3O2
MOLECULAR WEIGHT: 387.90304
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COCC3=CC=CC=C3)Cl
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Product OPENEYE NAME: ethyl 9-[(5-chloro-2-thienyl)sulfonylamino]bicyclo[4.2.1]nonane-6-carboxylate
CAS Name: 9-[(5-chloro-2-thiophenyl)sulfonylamino]-6-bicyclo[4.2.1]nonanecarboxylic acid ethyl ester
IUPAC NAME: ethyl 9-[(5-chlorothiophen-2-yl)sulfonylamino]bicyclo[4.2.1]nonane-6-carboxylate
SYSTEMATIC NAME: ethyl 9-[(5-chloranylthiophen-2-yl)sulfonylamino]bicyclo[4.2.1]nonane-6-carboxylate
MOLECULAR FORMULA: C16H22ClNO4S2
MOLECULAR WEIGHT: 391.93318
SMILES: CCOC(=O)C12CCCCC(C1NS(=O)(=O)C3=CC=C(S3)Cl)CC2
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Product OPENEYE NAME: 5-chloro-N-[6-(hydroxymethyl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
CAS Name: 5-chloro-N-[6-(hydroxymethyl)-9-bicyclo[4.2.1]nonanyl]-2-thiophenesulfonamide
IUPAC NAME: 5-chloro-N-[6-(hydroxymethyl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 5-chloranyl-N-[6-(hydroxymethyl)-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C14H20ClNO3S2
MOLECULAR WEIGHT: 349.8965
SMILES: C1CCC2(CCC(C1)C2NS(=O)(=O)C3=CC=C(S3)Cl)CO
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Product OPENEYE NAME: 5-chloro-N-[6-[(E)-3-hydroxyprop-1-enyl]-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
CAS Name: 5-chloro-N-[6-[(E)-3-hydroxyprop-1-enyl]-9-bicyclo[4.2.1]nonanyl]-2-thiophenesulfonamide
IUPAC NAME: 5-chloro-N-[6-[(E)-3-hydroxyprop-1-enyl]-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 5-chloranyl-N-[6-[(E)-3-oxidanylprop-1-enyl]-9-bicyclo[4.2.1]nonanyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C16H22ClNO3S2
MOLECULAR WEIGHT: 375.93378
SMILES: C1CCC2(CCC(C1)C2NS(=O)(=O)C3=CC=C(S3)Cl)/C=C/CO
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Product OPENEYE NAME: (4Z)-4-[(2Z,5Z,7Z)-3,5-bis(methoxyamino)-7-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)hepta-2,5-dienylidene]-2-methoxy-cyclohexa-2,5-dien-1-one
CAS Name: (4Z)-4-[(2Z,5Z,7Z)-3,5-bis(methoxyamino)-7-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)hepta-2,5-dienylidene]-2-methoxy-1-cyclohexa-2,5-dienone
IUPAC NAME: (4Z)-4-[(2Z,5Z,7Z)-3,5-bis(methoxyamino)-7-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)hepta-2,5-dienylidene]-2-methoxycyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: (4Z)-4-[(2Z,5Z,7Z)-3,5-bis(methoxyamino)-7-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hepta-2,5-dienylidene]-2-methoxy-cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C23H26N2O6
MOLECULAR WEIGHT: 426.46234
SMILES: COC1=C/C(=C\C=C(/NOC)\C/C(=C/C=C/2\C=C(C(=O)C=C2)OC)/NOC)/C=CC1=O
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Product OPENEYE NAME: N-(9-bicyclo[4.2.1]nonanyl)-5-chloro-thiophene-2-sulfonamide
CAS Name: N-(9-bicyclo[4.2.1]nonanyl)-5-chloro-2-thiophenesulfonamide
IUPAC NAME: N-(9-bicyclo[4.2.1]nonanyl)-5-chlorothiophene-2-sulfonamide
SYSTEMATIC NAME: N-(9-bicyclo[4.2.1]nonanyl)-5-chloranyl-thiophene-2-sulfonamide
MOLECULAR FORMULA: C13H18ClNO2S2
MOLECULAR WEIGHT: 319.87052
SMILES: C1CCC2CCC(C1)C2NS(=O)(=O)C3=CC=C(S3)Cl
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Product OPENEYE NAME: (5S)-3-[4-[(6-methoxy-8-quinolyl)amino]pentyl]-2,2,5-trimethyl-imidazolidin-4-one
CAS Name: (5S)-3-[4-[(6-methoxy-8-quinolinyl)amino]pentyl]-2,2,5-trimethyl-4-imidazolidinone
IUPAC NAME: (5S)-3-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2,2,5-trimethylimidazolidin-4-one
SYSTEMATIC NAME: (5S)-3-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2,2,5-trimethyl-imidazolidin-4-one
MOLECULAR FORMULA: C21H30N4O2
MOLECULAR WEIGHT: 370.4885
SMILES: C[C@H]1C(=O)N(C(N1)(C)C)CCCC(C)NC2=C3C(=CC(=C2)OC)C=CC=N3
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Product OPENEYE NAME: 5-fluoro-3-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)-1H-pyrimidine-2,4-dione
CAS Name: 5-fluoro-3-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)-1H-pyrimidine-2,4-dione
IUPAC NAME: 5-fluoro-3-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-fluoranyl-3-(1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl)-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C13H12FN3O3
MOLECULAR WEIGHT: 277.251083
SMILES: C1C(OCC2=CC=CC=C2N1)N3C(=O)C(=CNC3=O)F
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