Saturday, October 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(p-tolyl)ethanone
CAS Name: 2-(2-methyl-4-nitro-1-imidazolyl)-1-(4-methylphenyl)ethanone
IUPAC NAME: 2-(2-methyl-4-nitroimidazol-1-yl)-1-(4-methylphenyl)ethanone
SYSTEMATIC NAME: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(4-methylphenyl)ethanone
MOLECULAR FORMULA: C13H13N3O3
MOLECULAR WEIGHT: 259.26062
SMILES: CC1=CC=C(C=C1)C(=O)CN2C=C(N=C2C)[N+](=O)[O-]
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Product OPENEYE NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-[4-(trifluoromethoxy)phenyl]methanone
CAS Name: [4-[4-nitro-2-(1-pyrrolyl)phenyl]-1-piperazinyl]-[4-(trifluoromethoxy)phenyl]methanone
IUPAC NAME: [4-(4-nitro-2-pyrrol-1-ylphenyl)piperazin-1-yl]-[4-(trifluoromethoxy)phenyl]methanone
SYSTEMATIC NAME: [4-(4-nitro-2-pyrrol-1-yl-phenyl)piperazin-1-yl]-[4-(trifluoromethyloxy)phenyl]methanone
MOLECULAR FORMULA: C22H19F3N4O4
MOLECULAR WEIGHT: 460.40587
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3)C(=O)C4=CC=C(C=C4)OC(F)(F)F
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Product OPENEYE NAME: 1-[3-(4-chlorophenoxy)propyl]-2-methyl-4-nitro-imidazole
CAS Name: 1-[3-(4-chlorophenoxy)propyl]-2-methyl-4-nitroimidazole
IUPAC NAME: 1-[3-(4-chlorophenoxy)propyl]-2-methyl-4-nitroimidazole
SYSTEMATIC NAME: 1-[3-(4-chloranylphenoxy)propyl]-2-methyl-4-nitro-imidazole
MOLECULAR FORMULA: C13H14ClN3O3
MOLECULAR WEIGHT: 295.72156
SMILES: CC1=NC(=CN1CCCOC2=CC=C(C=C2)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]imidazole
CAS Name: 1-[2-(2,5-dimethyl-1-pyrrolyl)-4-nitrophenyl]imidazole
IUPAC NAME: 1-[2-(2,5-dimethylpyrrol-1-yl)-4-nitrophenyl]imidazole
SYSTEMATIC NAME: 1-[2-(2,5-dimethylpyrrol-1-yl)-4-nitro-phenyl]imidazole
MOLECULAR FORMULA: C15H14N4O2
MOLECULAR WEIGHT: 282.29726
SMILES: CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3C=CN=C3)C
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Product OPENEYE NAME: 2-[3-(4-chlorophenoxy)propyl]isoindoline-1,3-dione
CAS Name: 2-[3-(4-chlorophenoxy)propyl]isoindole-1,3-dione
IUPAC NAME: 2-[3-(4-chlorophenoxy)propyl]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[3-(4-chloranylphenoxy)propyl]isoindole-1,3-dione
MOLECULAR FORMULA: C17H14ClNO3
MOLECULAR WEIGHT: 315.75096
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone
CAS Name: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-1-imidazolyl)ethanone
IUPAC NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitroimidazol-1-yl)ethanone
SYSTEMATIC NAME: 1-(4-fluorophenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone
MOLECULAR FORMULA: C12H10FN3O3
MOLECULAR WEIGHT: 263.224503
SMILES: CC1=NC(=CN1CC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanol
CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-4-nitro-1-imidazolyl)ethanol
IUPAC NAME: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-4-nitroimidazol-1-yl)ethanol
SYSTEMATIC NAME: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanol
MOLECULAR FORMULA: C15H17N3O5
MOLECULAR WEIGHT: 319.31258
SMILES: CC1=NC(=CN1CC(C2=CC3=C(C=C2)OCCCO3)O)[N+](=O)[O-]
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Product OPENEYE NAME: methyl 5-[(4-fluorophenyl)sulfonylamino]-2-morpholino-benzoate
CAS Name: 5-[(4-fluorophenyl)sulfonylamino]-2-(4-morpholinyl)benzoic acid methyl ester
IUPAC NAME: methyl 5-[(4-fluorophenyl)sulfonylamino]-2-morpholin-4-ylbenzoate
SYSTEMATIC NAME: methyl 5-[(4-fluorophenyl)sulfonylamino]-2-morpholin-4-yl-benzoate
MOLECULAR FORMULA: C18H19FN2O5S
MOLECULAR WEIGHT: 394.417263
SMILES: COC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)N3CCOCC3
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Product OPENEYE NAME: 4-[3-(4-chlorophenoxy)propylsulfanyl]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile
CAS Name: 4-[3-(4-chlorophenoxy)propylthio]-6-methyl-2-phenyl-5-pyrimidinecarbonitrile
IUPAC NAME: 4-[3-(4-chlorophenoxy)propylsulfanyl]-6-methyl-2-phenylpyrimidine-5-carbonitrile
SYSTEMATIC NAME: 4-[3-(4-chloranylphenoxy)propylsulfanyl]-6-methyl-2-phenyl-pyrimidine-5-carbonitrile
MOLECULAR FORMULA: C21H18ClN3OS
MOLECULAR WEIGHT: 395.90512
SMILES: CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCCCOC3=CC=C(C=C3)Cl)C#N
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