Monday, July 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (Z)-2-cyano-3-[2-(3-nitrophenyl)hydrazino]but-2-enethioamide
CAS Name: (Z)-2-cyano-3-[(3-nitrophenyl)hydrazo]-2-butenethioamide
IUPAC NAME: (Z)-2-cyano-3-[2-(3-nitrophenyl)hydrazinyl]but-2-enethioamide
SYSTEMATIC NAME: (Z)-2-cyano-3-[2-(3-nitrophenyl)hydrazinyl]but-2-enethioamide
MOLECULAR FORMULA: C11H11N5O2S
MOLECULAR WEIGHT: 277.30234
SMILES: C/C(=C(\C#N)/C(=S)N)/NNC1=CC(=CC=C1)[N+](=O)[O-]
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Product OPENEYE NAME: (1-norbornan-2-yl-3-phenyl-aziridin-2-yl)-phenyl-methanone
CAS Name: [1-(3-bicyclo[2.2.1]heptanyl)-3-phenyl-2-aziridinyl]-phenylmethanone
IUPAC NAME: [1-(3-bicyclo[2.2.1]heptanyl)-3-phenylaziridin-2-yl]-phenylmethanone
SYSTEMATIC NAME: [1-(3-bicyclo[2.2.1]heptanyl)-3-phenyl-aziridin-2-yl]-phenyl-methanone
MOLECULAR FORMULA: C22H23NO
MOLECULAR WEIGHT: 317.42412
SMILES: C1CC2CC1CC2N3C(C3C(=O)C4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: (1-ethyl-3-phenyl-aziridin-2-yl)-(4-phenylphenyl)methanone
CAS Name: (1-ethyl-3-phenyl-2-aziridinyl)-(4-phenylphenyl)methanone
IUPAC NAME: (1-ethyl-3-phenylaziridin-2-yl)-(4-phenylphenyl)methanone
SYSTEMATIC NAME: (1-ethyl-3-phenyl-aziridin-2-yl)-(4-phenylphenyl)methanone
MOLECULAR FORMULA: C23H21NO
MOLECULAR WEIGHT: 327.41894
SMILES: CCN1C(C1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (1-isopropyl-3-phenyl-aziridin-2-yl)-(4-phenylphenyl)methanone
CAS Name: (4-phenylphenyl)-(3-phenyl-1-propan-2-yl-2-aziridinyl)methanone
IUPAC NAME: (4-phenylphenyl)-(3-phenyl-1-propan-2-ylaziridin-2-yl)methanone
SYSTEMATIC NAME: (4-phenylphenyl)-(3-phenyl-1-propan-2-yl-aziridin-2-yl)methanone
MOLECULAR FORMULA: C24H23NO
MOLECULAR WEIGHT: 341.44552
SMILES: CC(C)N1C(C1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: [1-(2,2-dimethylpropyl)-3-phenyl-aziridin-2-yl]-phenyl-methanone
CAS Name: [1-(2,2-dimethylpropyl)-3-phenyl-2-aziridinyl]-phenylmethanone
IUPAC NAME: [1-(2,2-dimethylpropyl)-3-phenylaziridin-2-yl]-phenylmethanone
SYSTEMATIC NAME: [1-(2,2-dimethylpropyl)-3-phenyl-aziridin-2-yl]-phenyl-methanone
MOLECULAR FORMULA: C20H23NO
MOLECULAR WEIGHT: 293.40272
SMILES: CC(C)(C)CN1C(C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (1-benzhydryl-3-phenyl-aziridin-2-yl)-phenyl-methanone
CAS Name: [1-(diphenylmethyl)-3-phenyl-2-aziridinyl]-phenylmethanone
IUPAC NAME: (1-benzhydryl-3-phenylaziridin-2-yl)-phenylmethanone
SYSTEMATIC NAME: [1-(diphenylmethyl)-3-phenyl-aziridin-2-yl]-phenyl-methanone
MOLECULAR FORMULA: C28H23NO
MOLECULAR WEIGHT: 389.48832
SMILES: C1=CC=C(C=C1)C2C(N2C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5
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Product OPENEYE NAME: (1-cyclohexyl-3-methyl-aziridin-2-yl)-phenyl-methanone
CAS Name: (1-cyclohexyl-3-methyl-2-aziridinyl)-phenylmethanone
IUPAC NAME: (1-cyclohexyl-3-methylaziridin-2-yl)-phenylmethanone
SYSTEMATIC NAME: (1-cyclohexyl-3-methyl-aziridin-2-yl)-phenyl-methanone
MOLECULAR FORMULA: C16H21NO
MOLECULAR WEIGHT: 243.34404
SMILES: CC1C(N1C2CCCCC2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [(3R,3aS,5R,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] acetate
CAS Name: acetic acid [(3R,3aS,5R,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] ester
IUPAC NAME: [(3R,3aS,5R,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] acetate
SYSTEMATIC NAME: [(3R,3aS,5R,7aR)-5-tert-butyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] ethanoate
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CC(=O)O[C@@H]1[C@H]2C[C@@H](CC[C@H]2OC1=O)C(C)(C)C
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Product OPENEYE NAME: [(3R,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] acetate
CAS Name: acetic acid [(3R,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] ester
IUPAC NAME: [(3R,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] acetate
SYSTEMATIC NAME: [(3R,3aS,5S,7aR)-5-tert-butyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] ethanoate
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CC(=O)O[C@@H]1[C@H]2C[C@H](CC[C@H]2OC1=O)C(C)(C)C
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Product OPENEYE NAME: [(3S,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] acetate
CAS Name: acetic acid [(3S,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] ester
IUPAC NAME: [(3S,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] acetate
SYSTEMATIC NAME: [(3S,3aS,7aR)-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] ethanoate
MOLECULAR FORMULA: C10H14O4
MOLECULAR WEIGHT: 198.21576
SMILES: CC(=O)O[C@H]1[C@H]2CCCC[C@H]2OC1=O
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Product OPENEYE NAME: [(3R,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] acetate
CAS Name: acetic acid [(3R,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] ester
IUPAC NAME: [(3R,3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] acetate
SYSTEMATIC NAME: [(3R,3aS,7aR)-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] ethanoate
MOLECULAR FORMULA: C10H14O4
MOLECULAR WEIGHT: 198.21576
SMILES: CC(=O)O[C@@H]1[C@H]2CCCC[C@H]2OC1=O
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Product OPENEYE NAME: [(3S,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] acetate
CAS Name: acetic acid [(3S,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-3-yl] ester
IUPAC NAME: [(3S,3aS,5S,7aR)-5-tert-butyl-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] acetate
SYSTEMATIC NAME: [(3S,3aS,5S,7aR)-5-tert-butyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-3-yl] ethanoate
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CC(=O)O[C@H]1[C@H]2C[C@H](CC[C@H]2OC1=O)C(C)(C)C
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