Sunday, December 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (3-methyl-1-piperidyl)-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone
CAS Name: [(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-(3-methyl-1-piperidinyl)methanone
IUPAC NAME: [(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(3-methylpiperidin-1-yl)methanone
SYSTEMATIC NAME: [(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(3-methylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: CC1CCCN(C1)C(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: N-[(1S)-1-[[(4-fluorobenzoyl)amino]carbamoyl]-2-methyl-propyl]-2-methyl-benzamide
CAS Name: N-[(2S)-1-[[(4-fluorophenyl)-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
IUPAC NAME: N-[(2S)-1-[2-(4-fluorobenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(2S)-1-[2-(4-fluorophenyl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide
MOLECULAR FORMULA: C20H22FN3O3
MOLECULAR WEIGHT: 371.405383
SMILES: CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NNC(=O)C2=CC=C(C=C2)F
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Product OPENEYE NAME: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-(10-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetyl]amino]propanoate
CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[2-(10-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-1-oxoethyl]amino]propanoic acid methyl ester
IUPAC NAME: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-(10-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetyl]amino]propanoate
SYSTEMATIC NAME: methyl (2R)-3-(1H-indol-3-yl)-2-[2-[10-methyl-1,3-bis(oxidanylidene)-2,4-diazaspiro[4.5]decan-2-yl]ethanoylamino]propanoate
MOLECULAR FORMULA: C23H28N4O5
MOLECULAR WEIGHT: 440.49222
SMILES: CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)OC
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Product OPENEYE NAME: 2,6-difluoro-N-[(1S)-1-[(3-methoxyphenyl)carbamoyl]-2-methyl-propyl]benzamide
CAS Name: 2,6-difluoro-N-[(2S)-1-(3-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamide
IUPAC NAME: 2,6-difluoro-N-[(2S)-1-(3-methoxyanilino)-3-methyl-1-oxobutan-2-yl]benzamide
SYSTEMATIC NAME: 2,6-bis(fluoranyl)-N-[(2S)-1-[(3-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide
MOLECULAR FORMULA: C19H20F2N2O3
MOLECULAR WEIGHT: 362.370506
SMILES: CC(C)[C@@H](C(=O)NC1=CC(=CC=C1)OC)NC(=O)C2=C(C=CC=C2F)F
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Product OPENEYE NAME: N-[(1S)-1-[(4-fluorophenyl)carbamoyl]-2-methyl-propyl]-3,5-dimethoxy-benzamide
CAS Name: N-[(2S)-1-(4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide
IUPAC NAME: N-[(2S)-1-(4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide
SYSTEMATIC NAME: N-[(2S)-1-[(4-fluorophenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3,5-dimethoxy-benzamide
MOLECULAR FORMULA: C20H23FN2O4
MOLECULAR WEIGHT: 374.406023
SMILES: CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)F)NC(=O)C2=CC(=CC(=C2)OC)OC
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Product OPENEYE NAME: 2-chloro-N-[(1S)-1-methyl-2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]benzamide
CAS Name: 2-chloro-N-[(2S)-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl]benzamide
IUPAC NAME: 2-chloro-N-[(2S)-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[(2S)-1-oxidanylidene-1-(2-thiophen-2-ylethylamino)propan-2-yl]benzamide
MOLECULAR FORMULA: C16H17ClN2O2S
MOLECULAR WEIGHT: 336.83638
SMILES: C[C@@H](C(=O)NCCC1=CC=CS1)NC(=O)C2=CC=CC=C2Cl
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Product OPENEYE NAME: (2S)-N-butyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-N-butyl-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-butyl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-butyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C16H24N2O3S
MOLECULAR WEIGHT: 324.43836
SMILES: CCCCNC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)C
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Product OPENEYE NAME: (3,5-dimethyl-1-piperidyl)-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone
CAS Name: (3,5-dimethyl-1-piperidinyl)-[(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methanone
IUPAC NAME: (3,5-dimethylpiperidin-1-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone
SYSTEMATIC NAME: (3,5-dimethylpiperidin-1-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone
MOLECULAR FORMULA: C19H28N2O3S
MOLECULAR WEIGHT: 364.50222
SMILES: CC1CC(CN(C1)C(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C)C
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Product OPENEYE NAME: ethyl 1-[(2S)-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]piperidine-4-carboxylate
CAS Name: 1-[[(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylpiperidine-4-carboxylate
MOLECULAR FORMULA: C20H28N2O5S
MOLECULAR WEIGHT: 408.51172
SMILES: CCOC(=O)C1CCN(CC1)C(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: N-[(1S)-1-methyl-2-[4-(3-methylphenoxy)anilino]-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[(2S)-1-[4-(3-methylphenoxy)anilino]-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[(2S)-1-[4-(3-methylphenoxy)anilino]-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(2S)-1-[[4-(3-methylphenoxy)phenyl]amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C21H20N2O4
MOLECULAR WEIGHT: 364.3945
SMILES: CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)[C@H](C)NC(=O)C3=CC=CO3
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Product OPENEYE NAME: (2S)-N-[1-(4-isopropylphenyl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-[oxo(thiophen-2-yl)methyl]-N-[1-(4-propan-2-ylphenyl)ethyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-[1-(4-propan-2-ylphenyl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-[1-(4-propan-2-ylphenyl)ethyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C21H26N2O2S
MOLECULAR WEIGHT: 370.50834
SMILES: CC(C)C1=CC=C(C=C1)C(C)NC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3
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Product OPENEYE NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide
CAS Name: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide
IUPAC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide
SYSTEMATIC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide
MOLECULAR FORMULA: C20H25ClN2O4S
MOLECULAR WEIGHT: 424.9415
SMILES: CC(C)[C@@H](C(=O)NC(C)C1=CC(=CC=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: (4-methyl-1-piperidyl)-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone
CAS Name: [(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-(4-methyl-1-piperidinyl)methanone
IUPAC NAME: [(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(4-methylpiperidin-1-yl)methanone
SYSTEMATIC NAME: [(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(4-methylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: CC1CCN(CC1)C(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanamide
CAS Name: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide
IUPAC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide
SYSTEMATIC NAME: (2S)-N-[1-(3-chlorophenyl)ethyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanamide
MOLECULAR FORMULA: C19H22ClFN2O3S
MOLECULAR WEIGHT: 412.905983
SMILES: CC(C)[C@@H](C(=O)NC(C)C1=CC(=CC=C1)Cl)NS(=O)(=O)C2=CC=CC=C2F
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