Saturday, May 18, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (4S)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-1-(p-tolyl)pyrrolidin-2-one
CAS Name: (4S)-4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-1-(4-methylphenyl)-2-pyrrolidinone
IUPAC NAME: (4S)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one
SYSTEMATIC NAME: (4S)-4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-1-(4-methylphenyl)pyrrolidin-2-one
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O
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Product OPENEYE NAME: (4R)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-1-(p-tolyl)pyrrolidin-2-one
CAS Name: (4R)-4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-1-(4-methylphenyl)-2-pyrrolidinone
IUPAC NAME: (4R)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one
SYSTEMATIC NAME: (4R)-4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-1-(4-methylphenyl)pyrrolidin-2-one
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: CC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-benzamidobutanoate
CAS Name: (3S)-3-benzamidobutanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-benzamidobutanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-benzamidobutanoate
MOLECULAR FORMULA: C21H19N3O3
MOLECULAR WEIGHT: 361.39386
SMILES: C[C@@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-benzamidobutanoate
CAS Name: (3R)-3-benzamidobutanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-benzamidobutanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-benzamidobutanoate
MOLECULAR FORMULA: C21H19N3O3
MOLECULAR WEIGHT: 361.39386
SMILES: C[C@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (4S)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]pyrrolidin-2-one
CAS Name: (4S)-1-(2,3-dimethylphenyl)-4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-2-pyrrolidinone
IUPAC NAME: (4S)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]pyrrolidin-2-one
SYSTEMATIC NAME: (4S)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-pyrrolidin-2-one
MOLECULAR FORMULA: C25H28N2O4
MOLECULAR WEIGHT: 420.50082
SMILES: CC1=C(C(=CC=C1)N2C[C@H](CC2=O)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O)C
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Product OPENEYE NAME: (4R)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]pyrrolidin-2-one
CAS Name: (4R)-1-(2,3-dimethylphenyl)-4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-2-pyrrolidinone
IUPAC NAME: (4R)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxybenzoyl)piperidine-1-carbonyl]pyrrolidin-2-one
SYSTEMATIC NAME: (4R)-1-(2,3-dimethylphenyl)-4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]carbonyl-pyrrolidin-2-one
MOLECULAR FORMULA: C25H28N2O4
MOLECULAR WEIGHT: 420.50082
SMILES: CC1=C(C(=CC=C1)N2C[C@@H](CC2=O)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O)C
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-chlorophenyl)propanoate
CAS Name: (3S)-3-acetamido-3-(4-chlorophenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-chlorophenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-chlorophenyl)propanoate
MOLECULAR FORMULA: C21H18ClN3O3
MOLECULAR WEIGHT: 395.83892
SMILES: CC(=O)N[C@@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-chlorophenyl)propanoate
CAS Name: (3R)-3-acetamido-3-(4-chlorophenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-chlorophenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-chlorophenyl)propanoate
MOLECULAR FORMULA: C21H18ClN3O3
MOLECULAR WEIGHT: 395.83892
SMILES: CC(=O)N[C@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(p-tolyl)propanoate
CAS Name: (3S)-3-acetamido-3-(4-methylphenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-methylphenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-methylphenyl)propanoate
MOLECULAR FORMULA: C22H21N3O3
MOLECULAR WEIGHT: 375.42044
SMILES: CC1=CC=C(C=C1)[C@H](CC(=O)OCC2=CN3C=CC=CC3=C2C#N)NC(=O)C
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(p-tolyl)propanoate
CAS Name: (3R)-3-acetamido-3-(4-methylphenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-methylphenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-methylphenyl)propanoate
MOLECULAR FORMULA: C22H21N3O3
MOLECULAR WEIGHT: 375.42044
SMILES: CC1=CC=C(C=C1)[C@@H](CC(=O)OCC2=CN3C=CC=CC3=C2C#N)NC(=O)C
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-methoxyphenyl)propanoate
CAS Name: (3R)-3-acetamido-3-(4-methoxyphenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3R)-3-acetamido-3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C22H21N3O4
MOLECULAR WEIGHT: 391.41984
SMILES: CC(=O)N[C@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-methoxyphenyl)propanoate
CAS Name: (3S)-3-acetamido-3-(4-methoxyphenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-methoxyphenyl)propanoate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (3S)-3-acetamido-3-(4-methoxyphenyl)propanoate
MOLECULAR FORMULA: C22H21N3O4
MOLECULAR WEIGHT: 391.41984
SMILES: CC(=O)N[C@@H](CC(=O)OCC1=CN2C=CC=CC2=C1C#N)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: 2-[4-[4-(4-hydroxybenzoyl)-1-piperidyl]-4-oxo-butyl]-1H-quinazolin-4-one
CAS Name: 2-[4-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-4-oxobutyl]-1H-quinazolin-4-one
IUPAC NAME: 2-[4-[4-(4-hydroxybenzoyl)piperidin-1-yl]-4-oxobutyl]-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-[4-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]-4-oxidanylidene-butyl]-1H-quinazolin-4-one
MOLECULAR FORMULA: C24H25N3O4
MOLECULAR WEIGHT: 419.473
SMILES: C1CN(CCC1C(=O)C2=CC=C(C=C2)O)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3
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Product OPENEYE NAME: (2R)-2-[2-[4-(4-hydroxybenzoyl)-1-piperidyl]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide
CAS Name: (2R)-2-[[2-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide
IUPAC NAME: (2R)-2-[2-[4-(4-hydroxybenzoyl)piperidin-1-yl]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SYSTEMATIC NAME: (2R)-2-[2-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide
MOLECULAR FORMULA: C21H25N3O5S
MOLECULAR WEIGHT: 431.5053
SMILES: CC1=CC(=NO1)NC(=O)[C@@H](C)SCC(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2S)-2-[2-[4-(4-hydroxybenzoyl)-1-piperidyl]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide
CAS Name: (2S)-2-[[2-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperidinyl]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide
IUPAC NAME: (2S)-2-[2-[4-(4-hydroxybenzoyl)piperidin-1-yl]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SYSTEMATIC NAME: (2S)-2-[2-[4-(4-hydroxyphenyl)carbonylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide
MOLECULAR FORMULA: C21H25N3O5S
MOLECULAR WEIGHT: 431.5053
SMILES: CC1=CC(=NO1)NC(=O)[C@H](C)SCC(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzoyl]-4-piperidyl]methanone
CAS Name: (4-hydroxyphenyl)-[1-[[2-methyl-5-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]-4-piperidinyl]methanone
IUPAC NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzoyl]piperidin-4-yl]methanone
SYSTEMATIC NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[(2R)-2-methylpiperidin-1-yl]sulfonyl-phenyl]carbonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C26H32N2O5S
MOLECULAR WEIGHT: 484.60768
SMILES: C[C@@H]1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O
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Product OPENEYE NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzoyl]-4-piperidyl]methanone
CAS Name: (4-hydroxyphenyl)-[1-[[2-methyl-5-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]-4-piperidinyl]methanone
IUPAC NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzoyl]piperidin-4-yl]methanone
SYSTEMATIC NAME: (4-hydroxyphenyl)-[1-[2-methyl-5-[(2S)-2-methylpiperidin-1-yl]sulfonyl-phenyl]carbonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C26H32N2O5S
MOLECULAR WEIGHT: 484.60768
SMILES: C[C@H]1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)O
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