Saturday, April 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: methyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxo-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
CAS Name: (4R)-4-(2-chlorophenyl)-5-cyano-6-[(2-methoxy-2-oxoethyl)thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester
IUPAC NAME: methyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
SYSTEMATIC NAME: methyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
MOLECULAR FORMULA: C18H17ClN2O4S
MOLECULAR WEIGHT: 392.85658
SMILES: CC1=C([C@H](C(=C(N1)SCC(=O)OC)C#N)C2=CC=CC=C2Cl)C(=O)OC
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Product OPENEYE NAME: ethyl 2-amino-3-cyano-7,7-dimethyl-5-oxo-spiro[6,8-dihydrochromene-4,4'-piperidine]-1'-carboxylate
CAS Name: 2-amino-3-cyano-7,7-dimethyl-5-oxo-1'-spiro[6,8-dihydro-1-benzopyran-4,4'-piperidine]carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-3-cyano-7,7-dimethyl-5-oxospiro[6,8-dihydrochromene-4,4'-piperidine]-1'-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-spiro[6,8-dihydrochromene-4,4'-piperidine]-1'-carboxylate
MOLECULAR FORMULA: C19H25N3O4
MOLECULAR WEIGHT: 359.4195
SMILES: CCOC(=O)N1CCC2(CC1)C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N
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Product OPENEYE NAME: (4R)-6-amino-3-ethyl-4-(5-methyl-2-furyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4R)-6-amino-3-ethyl-4-(5-methyl-2-furanyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4R)-6-amino-3-ethyl-4-(5-methylfuran-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4R)-6-azanyl-3-ethyl-4-(5-methylfuran-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C14H14N4O2
MOLECULAR WEIGHT: 270.28656
SMILES: CCC1=C2[C@@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(O3)C
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Product OPENEYE NAME: (4S)-6-amino-3-ethyl-4-(5-methyl-2-furyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4S)-6-amino-3-ethyl-4-(5-methyl-2-furanyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4S)-6-amino-3-ethyl-4-(5-methylfuran-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4S)-6-azanyl-3-ethyl-4-(5-methylfuran-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C14H14N4O2
MOLECULAR WEIGHT: 270.28656
SMILES: CCC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(O3)C
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Product OPENEYE NAME: 2-[(4-nitro-2-thienyl)methylene]propanedinitrile
CAS Name: 2-[(4-nitro-2-thiophenyl)methylidene]propanedinitrile
IUPAC NAME: 2-[(4-nitrothiophen-2-yl)methylidene]propanedinitrile
SYSTEMATIC NAME: 2-[(4-nitrothiophen-2-yl)methylidene]propanedinitrile
MOLECULAR FORMULA: C8H3N3O2S
MOLECULAR WEIGHT: 205.19332
SMILES: C1=C(SC=C1[N+](=O)[O-])C=C(C#N)C#N
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Product OPENEYE NAME: ethyl 2-[(4R)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
CAS Name: 2-[(4R)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[(4R)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[(4R)-6-azanyl-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]ethanoate
MOLECULAR FORMULA: C18H18N4O4
MOLECULAR WEIGHT: 354.35992
SMILES: CCOC(=O)CC1=C2[C@@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: ethyl 2-[(4S)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
CAS Name: 2-[(4S)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[(4S)-6-amino-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[(4S)-6-azanyl-5-cyano-4-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]ethanoate
MOLECULAR FORMULA: C18H18N4O4
MOLECULAR WEIGHT: 354.35992
SMILES: CCOC(=O)CC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (4S)-2-amino-4-[5-chloro-3-methyl-1-(p-tolyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
CAS Name: (4S)-2-amino-4-[5-chloro-3-methyl-1-(4-methylphenyl)-4-pyrazolyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile
IUPAC NAME: (4S)-2-amino-4-[5-chloro-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
SYSTEMATIC NAME: (4S)-2-azanyl-4-[5-chloranyl-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile
MOLECULAR FORMULA: C23H23ClN4O2
MOLECULAR WEIGHT: 422.90732
SMILES: CC1=CC=C(C=C1)N2C(=C(C(=N2)C)[C@H]3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)Cl
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Product OPENEYE NAME: (4R)-2-amino-4-[5-chloro-3-methyl-1-(p-tolyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
CAS Name: (4R)-2-amino-4-[5-chloro-3-methyl-1-(4-methylphenyl)-4-pyrazolyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile
IUPAC NAME: (4R)-2-amino-4-[5-chloro-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
SYSTEMATIC NAME: (4R)-2-azanyl-4-[5-chloranyl-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile
MOLECULAR FORMULA: C23H23ClN4O2
MOLECULAR WEIGHT: 422.90732
SMILES: CC1=CC=C(C=C1)N2C(=C(C(=N2)C)[C@@H]3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)Cl
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Product OPENEYE NAME: 1'-acetyl-2-amino-5-oxo-spiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-3-carbonitrile
CAS Name: 1'-acetyl-2-amino-5-oxo-3-spiro[7,8-dihydro-6H-1-benzopyran-4,4'-piperidine]carbonitrile
IUPAC NAME: 1'-acetyl-2-amino-5-oxospiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1'-ethanoyl-5-oxidanylidene-spiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-3-carbonitrile
MOLECULAR FORMULA: C16H19N3O3
MOLECULAR WEIGHT: 301.34036
SMILES: CC(=O)N1CCC2(CC1)C(=C(OC3=C2C(=O)CCC3)N)C#N
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Product OPENEYE NAME: tert-butyl 2-amino-3-cyano-5-oxo-spiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-1'-carboxylate
CAS Name: 2-amino-3-cyano-5-oxo-1'-spiro[7,8-dihydro-6H-1-benzopyran-4,4'-piperidine]carboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 2-amino-3-cyano-5-oxospiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-1'-carboxylate
SYSTEMATIC NAME: tert-butyl 2-azanyl-3-cyano-5-oxidanylidene-spiro[7,8-dihydro-6H-chromene-4,4'-piperidine]-1'-carboxylate
MOLECULAR FORMULA: C19H25N3O4
MOLECULAR WEIGHT: 359.4195
SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)C(=C(OC3=C2C(=O)CCC3)N)C#N
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