Saturday, May 18, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(3-phenylprop-2-ynyl)-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide
CAS Name: N-(3-phenylprop-2-ynyl)-4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxamide
IUPAC NAME: N-(3-phenylprop-2-ynyl)-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide
SYSTEMATIC NAME: N-(3-phenylprop-2-ynyl)-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide
MOLECULAR FORMULA: C18H19N3O3S
MOLECULAR WEIGHT: 357.42676
SMILES: C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCC#CC3=CC=CC=C3
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Product OPENEYE NAME: 2-methyl-N-(3-phenylprop-2-ynyl)-5-sulfamoyl-benzamide
CAS Name: 2-methyl-N-(3-phenylprop-2-ynyl)-5-sulfamoylbenzamide
IUPAC NAME: 2-methyl-N-(3-phenylprop-2-ynyl)-5-sulfamoylbenzamide
SYSTEMATIC NAME: 2-methyl-N-(3-phenylprop-2-ynyl)-5-sulfamoyl-benzamide
MOLECULAR FORMULA: C17H16N2O3S
MOLECULAR WEIGHT: 328.38554
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NCC#CC2=CC=CC=C2
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Product OPENEYE NAME: 5-chloro-N-(3-phenylprop-2-ynyl)furan-2-carboxamide
CAS Name: 5-chloro-N-(3-phenylprop-2-ynyl)-2-furancarboxamide
IUPAC NAME: 5-chloro-N-(3-phenylprop-2-ynyl)furan-2-carboxamide
SYSTEMATIC NAME: 5-chloranyl-N-(3-phenylprop-2-ynyl)furan-2-carboxamide
MOLECULAR FORMULA: C14H10ClNO2
MOLECULAR WEIGHT: 259.6877
SMILES: C1=CC=C(C=C1)C#CCNC(=O)C2=CC=C(O2)Cl
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Product OPENEYE NAME: (2R)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
CAS Name: (2R)-2-methyl-1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-1-butanone
IUPAC NAME: (2R)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
SYSTEMATIC NAME: (2R)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: CC[C@@H](C)C(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3
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Product OPENEYE NAME: (2S)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
CAS Name: (2S)-2-methyl-1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-1-butanone
IUPAC NAME: (2S)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
SYSTEMATIC NAME: (2S)-2-methyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: CC[C@H](C)C(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxylate
CAS Name: (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (2R,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate
MOLECULAR FORMULA: C27H29N3O4
MOLECULAR WEIGHT: 459.53686
SMILES: CCCCN1[C@H]([C@H](CCC1=O)C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC=CC=C4OC
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (2S,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxylate
CAS Name: (2S,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (2S,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (2S,3S)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate
MOLECULAR FORMULA: C27H29N3O4
MOLECULAR WEIGHT: 459.53686
SMILES: CCCCN1[C@@H]([C@H](CCC1=O)C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC=CC=C4OC
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (2R,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxylate
CAS Name: (2R,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (2R,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (2R,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate
MOLECULAR FORMULA: C27H29N3O4
MOLECULAR WEIGHT: 459.53686
SMILES: CCCCN1[C@H]([C@@H](CCC1=O)C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC=CC=C4OC
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Product OPENEYE NAME: (1-cyanoindolizin-2-yl)methyl (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxylate
CAS Name: (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester
IUPAC NAME: (1-cyanoindolizin-2-yl)methyl (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylate
SYSTEMATIC NAME: (1-cyanoindolizin-2-yl)methyl (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate
MOLECULAR FORMULA: C27H29N3O4
MOLECULAR WEIGHT: 459.53686
SMILES: CCCCN1[C@@H]([C@@H](CCC1=O)C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC=CC=C4OC
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Product OPENEYE NAME: [3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl 5-oxo-2,3-dihydrothiazolo[3,2-a]pyrimidine-6-carboxylate
CAS Name: 5-oxo-2,3-dihydrothiazolo[3,2-a]pyrimidine-6-carboxylic acid [3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester
IUPAC NAME: [3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: [3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl 5-oxidanylidene-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C17H13FN4O4S
MOLECULAR WEIGHT: 388.372923
SMILES: CC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=CN=C4N(C3=O)CCS4)F
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