Tuesday, May 1, 2012

All Chemical Compounds Information



Product OPENEYE NAME: ethyl (3aS,6aS)-1-acetyl-5-(3-chloro-4-methyl-phenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aS,6aS)-1-acetyl-5-(3-chloro-4-methylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aS,6aS)-1-acetyl-5-(3-chloro-4-methylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aS,6aS)-5-(3-chloranyl-4-methyl-phenyl)-1-ethanoyl-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C17H16ClN3O5
MOLECULAR WEIGHT: 377.77904
SMILES: CCOC(=O)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)C(=O)C
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Product OPENEYE NAME: ethyl (3aR,6aS)-1-acetyl-5-(3-chloro-4-methyl-phenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aR,6aS)-1-acetyl-5-(3-chloro-4-methylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aR,6aS)-1-acetyl-5-(3-chloro-4-methylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aR,6aS)-5-(3-chloranyl-4-methyl-phenyl)-1-ethanoyl-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C17H16ClN3O5
MOLECULAR WEIGHT: 377.77904
SMILES: CCOC(=O)C1=NN([C@H]2[C@H]1C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)C(=O)C
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Product OPENEYE NAME: ethyl (3aR,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aR,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aR,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aR,6aS)-1-ethanoyl-5-(4-ethylphenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C18H19N3O5
MOLECULAR WEIGHT: 357.36056
SMILES: CCC1=CC=C(C=C1)N2C(=O)[C@@H]3[C@@H](C2=O)N(N=C3C(=O)OCC)C(=O)C
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Product OPENEYE NAME: ethyl (3aR,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aR,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aR,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aR,6aR)-1-ethanoyl-5-(4-ethylphenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C18H19N3O5
MOLECULAR WEIGHT: 357.36056
SMILES: CCC1=CC=C(C=C1)N2C(=O)[C@@H]3[C@H](C2=O)N(N=C3C(=O)OCC)C(=O)C
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Product OPENEYE NAME: ethyl (3aS,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aS,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aS,6aS)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aS,6aS)-1-ethanoyl-5-(4-ethylphenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C18H19N3O5
MOLECULAR WEIGHT: 357.36056
SMILES: CCC1=CC=C(C=C1)N2C(=O)[C@H]3[C@@H](C2=O)N(N=C3C(=O)OCC)C(=O)C
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Product OPENEYE NAME: ethyl (3aS,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS Name: (3aS,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (3aS,6aR)-1-acetyl-5-(4-ethylphenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl (3aS,6aR)-1-ethanoyl-5-(4-ethylphenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
MOLECULAR FORMULA: C18H19N3O5
MOLECULAR WEIGHT: 357.36056
SMILES: CCC1=CC=C(C=C1)N2C(=O)[C@H]3[C@H](C2=O)N(N=C3C(=O)OCC)C(=O)C
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexyl(p-tolylsulfonyl)amino]acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexyl-(4-methylphenyl)sulfonylamino]acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexyl-(4-methylphenyl)sulfonylamino]acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexyl-(4-methylphenyl)sulfonyl-amino]ethanamide
MOLECULAR FORMULA: C23H28N2O5S
MOLECULAR WEIGHT: 444.54382
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)C4CCCCC4
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[methyl(p-tolylsulfonyl)amino]acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanamide
MOLECULAR FORMULA: C18H20N2O5S
MOLECULAR WEIGHT: 376.4268
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: (6R)-9,9-dimethyl-6-(4-methylsulfanylphenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
CAS Name: (6R)-9,9-dimethyl-6-[4-(methylthio)phenyl]-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
IUPAC NAME: (6R)-9,9-dimethyl-6-(4-methylsulfanylphenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: (6R)-9,9-dimethyl-6-(4-methylsulfanylphenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C22H24N2OS
MOLECULAR WEIGHT: 364.50376
SMILES: CC1(CC2=C([C@H](NC3=CC=CC=C3N2)C4=CC=C(C=C4)SC)C(=O)C1)C
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