Product OPENEYE NAME: (3-methoxycarbonylphenyl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid (3-methoxycarbonylphenyl)methyl ester
IUPAC NAME: (3-methoxycarbonylphenyl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate
SYSTEMATIC NAME: (3-methoxycarbonylphenyl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
MOLECULAR FORMULA: C20H18N2O4S
MOLECULAR WEIGHT: 382.43292
SMILES: COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC(=NC(=C2C#N)SC)C3CC3
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Product OPENEYE NAME: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
IUPAC NAME: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
SYSTEMATIC NAME: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)propanamide
MOLECULAR FORMULA: C19H23N3O4S
MOLECULAR WEIGHT: 389.46862
SMILES: CC1=C(C(=O)N=C(N1)C2=CC=CC=C2)CCC(=O)N[C@]3(CCS(=O)(=O)C3)C
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Product OPENEYE NAME: N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
CAS Name: N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
IUPAC NAME: N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
SYSTEMATIC NAME: N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)propanamide
MOLECULAR FORMULA: C19H23N3O4S
MOLECULAR WEIGHT: 389.46862
SMILES: CC1=C(C(=O)N=C(N1)C2=CC=CC=C2)CCC(=O)N[C@@]3(CCS(=O)(=O)C3)C
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Product OPENEYE NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]acetamide
CAS Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]acetamide
IUPAC NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]acetamide
SYSTEMATIC NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide
MOLECULAR FORMULA: C17H22N4O3S2
MOLECULAR WEIGHT: 394.51158
SMILES: CC1=C(C=C(C=C1)N2C=NN=C2SCC(=O)N[C@]3(CCS(=O)(=O)C3)C)C
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Product OPENEYE NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]acetamide
CAS Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]acetamide
IUPAC NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]acetamide
SYSTEMATIC NAME: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]ethanamide
MOLECULAR FORMULA: C17H22N4O3S2
MOLECULAR WEIGHT: 394.51158
SMILES: CC1=C(C=C(C=C1)N2C=NN=C2SCC(=O)N[C@@]3(CCS(=O)(=O)C3)C)C
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Product OPENEYE NAME: (2R)-2-[(1-acetylindolin-5-yl)amino]-N-(5-quinolyl)propanamide
CAS Name: (2R)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-(5-quinolinyl)propanamide
IUPAC NAME: (2R)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-quinolin-5-ylpropanamide
SYSTEMATIC NAME: (2R)-2-[(1-ethanoyl-2,3-dihydroindol-5-yl)amino]-N-quinolin-5-yl-propanamide
MOLECULAR FORMULA: C22H22N4O2
MOLECULAR WEIGHT: 374.43568
SMILES: C[C@H](C(=O)NC1=CC=CC2=C1C=CC=N2)NC3=CC4=C(C=C3)N(CC4)C(=O)C
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Product OPENEYE NAME: (2S)-2-[(1-acetylindolin-5-yl)amino]-N-(5-quinolyl)propanamide
CAS Name: (2S)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-(5-quinolinyl)propanamide
IUPAC NAME: (2S)-2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-N-quinolin-5-ylpropanamide
SYSTEMATIC NAME: (2S)-2-[(1-ethanoyl-2,3-dihydroindol-5-yl)amino]-N-quinolin-5-yl-propanamide
MOLECULAR FORMULA: C22H22N4O2
MOLECULAR WEIGHT: 374.43568
SMILES: C[C@@H](C(=O)NC1=CC=CC2=C1C=CC=N2)NC3=CC4=C(C=C3)N(CC4)C(=O)C
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Product OPENEYE NAME: 1-[5-[[(1R)-1-(1-benzyl-5-chloro-benzimidazol-2-yl)ethyl]amino]indolin-1-yl]ethanone
CAS Name: 1-[5-[[(1R)-1-[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 1-[5-[[(1R)-1-(1-benzyl-5-chlorobenzimidazol-2-yl)ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 1-[5-[[(1R)-1-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C26H25ClN4O
MOLECULAR WEIGHT: 444.9559
SMILES: C[C@H](C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl)NC4=CC5=C(C=C4)N(CC5)C(=O)C
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Product OPENEYE NAME: 1-[5-[[(1S)-1-(1-benzyl-5-chloro-benzimidazol-2-yl)ethyl]amino]indolin-1-yl]ethanone
CAS Name: 1-[5-[[(1S)-1-[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
IUPAC NAME: 1-[5-[[(1S)-1-(1-benzyl-5-chlorobenzimidazol-2-yl)ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
SYSTEMATIC NAME: 1-[5-[[(1S)-1-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]ethyl]amino]-2,3-dihydroindol-1-yl]ethanone
MOLECULAR FORMULA: C26H25ClN4O
MOLECULAR WEIGHT: 444.9559
SMILES: C[C@@H](C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl)NC4=CC5=C(C=C4)N(CC5)C(=O)C
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Product OPENEYE NAME: (2-acetamidothiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester
IUPAC NAME: (2-acetamido-1,3-thiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate
SYSTEMATIC NAME: (2-acetamido-1,3-thiazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
MOLECULAR FORMULA: C17H16N4O3S2
MOLECULAR WEIGHT: 388.46394
SMILES: CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=NC(=C2C#N)SC)C3CC3
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Product OPENEYE NAME: (2-phenyloxazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid (2-phenyl-4-oxazolyl)methyl ester
IUPAC NAME: (2-phenyl-1,3-oxazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate
SYSTEMATIC NAME: (2-phenyl-1,3-oxazol-4-yl)methyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
MOLECULAR FORMULA: C21H17N3O3S
MOLECULAR WEIGHT: 391.44298
SMILES: CSC1=C(C(=CC(=N1)C2CC2)C(=O)OCC3=COC(=N3)C4=CC=CC=C4)C#N
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Product OPENEYE NAME: 3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
CAS Name: 3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxylic acid 3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl ester
IUPAC NAME: 3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl 3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxylate
SYSTEMATIC NAME: 3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl 3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxylate
MOLECULAR FORMULA: C21H22N6O4S
MOLECULAR WEIGHT: 454.50218
SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCOC(=O)C3=CC(=NC(=C3C#N)SC)C4CC4
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Product OPENEYE NAME: 6-[[[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]amino]carbamoyl]pyridazin-3-olate
CAS Name: 6-[[[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]-3-pyridazinolate
IUPAC NAME: 6-[[[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]amino]carbamoyl]pyridazin-3-olate
SYSTEMATIC NAME: 6-[[[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonylamino]carbamoyl]pyridazin-3-olate
MOLECULAR FORMULA: C19H14ClN4O3S-
MOLECULAR WEIGHT: 413.85746
SMILES: C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)NNC(=O)C3=NN=C(C=C3)[O-]
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Product OPENEYE NAME: N'-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]-6-oxo-1H-pyridazine-3-carbohydrazide
CAS Name: N'-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]-6-oxo-1H-pyridazine-3-carbohydrazide
IUPAC NAME: N'-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]-6-oxo-1H-pyridazine-3-carbohydrazide
SYSTEMATIC NAME: N'-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyl-6-oxidanylidene-1H-pyridazine-3-carbohydrazide
MOLECULAR FORMULA: C19H15ClN4O3S
MOLECULAR WEIGHT: 414.8654
SMILES: C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)NNC(=O)C3=NNC(=O)C=C3
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Product OPENEYE NAME: N-[(1R)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide
CAS Name: N-[(1R)-1-phenylethyl]-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide
IUPAC NAME: N-[(1R)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide
SYSTEMATIC NAME: N-[(1R)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide
MOLECULAR FORMULA: C18H22N2O3S2
MOLECULAR WEIGHT: 378.50888
SMILES: C[C@H](C1=CC=CC=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCC3
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Product OPENEYE NAME: N-[(1S)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide
CAS Name: N-[(1S)-1-phenylethyl]-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide
IUPAC NAME: N-[(1S)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide
SYSTEMATIC NAME: N-[(1S)-1-phenylethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide
MOLECULAR FORMULA: C18H22N2O3S2
MOLECULAR WEIGHT: 378.50888
SMILES: C[C@@H](C1=CC=CC=C1)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCC3
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Product OPENEYE NAME: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methoxyethoxy)acetamide
CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methoxyethoxy)acetamide
IUPAC NAME: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methoxyethoxy)acetamide
SYSTEMATIC NAME: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methoxyethoxy)ethanamide
MOLECULAR FORMULA: C14H18ClNO5
MOLECULAR WEIGHT: 315.74942
SMILES: COCCOCC(=O)NC1=CC2=C(C=C1Cl)OCCCO2
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Product OPENEYE NAME: 1-acetyl-N'-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]piperidine-4-carbohydrazide
CAS Name: 1-acetyl-N'-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]-4-piperidinecarbohydrazide
IUPAC NAME: 1-acetyl-N'-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]piperidine-4-carbohydrazide
SYSTEMATIC NAME: N'-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyl-1-ethanoyl-piperidine-4-carbohydrazide
MOLECULAR FORMULA: C22H24ClN3O3S
MOLECULAR WEIGHT: 445.96226
SMILES: CC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl
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