Friday, October 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: N-(3-benzoyl-2-fluoro-phenyl)-2-bromo-acetamide
CAS Name: N-(3-benzoyl-2-fluorophenyl)-2-bromoacetamide
IUPAC NAME: N-(3-benzoyl-2-fluorophenyl)-2-bromoacetamide
SYSTEMATIC NAME: 2-bromanyl-N-[2-fluoranyl-3-(phenylcarbonyl)phenyl]ethanamide
MOLECULAR FORMULA: C15H11BrFNO2
MOLECULAR WEIGHT: 336.155743
SMILES: C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)NC(=O)CBr)F
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Product OPENEYE NAME: 1-isobutyl-5H-1,4-benzodiazepin-2-one
CAS Name: 1-(2-methylpropyl)-5H-1,4-benzodiazepin-2-one
IUPAC NAME: 1-(2-methylpropyl)-5H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 1-(2-methylpropyl)-5H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C13H16N2O
MOLECULAR WEIGHT: 216.27894
SMILES: CC(C)CN1C2=CC=CC=C2CN=CC1=O
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Product OPENEYE NAME: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one hydrobromide
CAS Name: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one hydrobromide
IUPAC NAME: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one hydrobromide
SYSTEMATIC NAME: 3-azanyl-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one hydrobromide
MOLECULAR FORMULA: C25H22BrN7O5
MOLECULAR WEIGHT: 580.39008
SMILES: CC1=C2C(N=C(C(=O)N(C2=CC=C1)C3=CN(CN3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])N)C5=CC=CC=C5.Br
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Product OPENEYE NAME: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one
CAS Name: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one
IUPAC NAME: 3-amino-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 3-azanyl-1-[3-(2,4-dinitrophenyl)-1,2-dihydroimidazol-5-yl]-6-methyl-5-phenyl-5H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C25H21N7O5
MOLECULAR WEIGHT: 499.47814
SMILES: CC1=C2C(N=C(C(=O)N(C2=CC=C1)C3=CN(CN3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])N)C5=CC=CC=C5
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Product OPENEYE NAME: benzyl N-(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)carbamate
CAS Name: N-(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-(2-oxo-5-phenyl-1,4-benzodiazepin-3-yl)carbamate
SYSTEMATIC NAME: (phenylmethyl) N-(2-oxidanylidene-5-phenyl-1,4-benzodiazepin-3-yl)carbamate
MOLECULAR FORMULA: C23H17N3O3
MOLECULAR WEIGHT: 383.39938
SMILES: C1=CC=C(C=C1)COC(=O)NC2=NC(=C3C=CC=CC3=NC2=O)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-methoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-methoxy-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-methoxybenzimidazol-2-yl]-5-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-methoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C17H18N4O5S
MOLECULAR WEIGHT: 390.41362
SMILES: CC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OC
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Product OPENEYE NAME: 1-[1-(dimethylsulfamoyl)-4-isopropoxy-benzimidazol-2-yl]-4H-quinoline-3-carboxylic acid
CAS Name: 1-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-2-benzimidazolyl]-4H-quinoline-3-carboxylic acid
IUPAC NAME: 1-[1-(dimethylsulfamoyl)-4-propan-2-yloxybenzimidazol-2-yl]-4H-quinoline-3-carboxylic acid
SYSTEMATIC NAME: 1-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-benzimidazol-2-yl]-4H-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C22H24N4O5S
MOLECULAR WEIGHT: 456.51476
SMILES: CC(C)OC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)N3C=C(CC4=CC=CC=C43)C(=O)O
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-propoxy-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxybenzimidazol-2-yl]-6-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C19H22N4O5S
MOLECULAR WEIGHT: 418.46678
SMILES: CCCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=C(C=CC(=N3)C)C(=O)O
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-propoxy-2-benzimidazolyl]-5-ethyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxybenzimidazol-2-yl]-5-ethylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C20H24N4O5S
MOLECULAR WEIGHT: 432.49336
SMILES: CCCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=NC=C(C=C3C(=O)O)CC
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-ethoxybenzimidazol-2-yl]-6-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C18H20N4O5S
MOLECULAR WEIGHT: 404.4402
SMILES: CCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=C(C=CC(=N3)C)C(=O)O
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Product OPENEYE NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[5-chloro-1-(dimethylsulfamoyl)-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-5-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[5-chloranyl-1-(dimethylsulfamoyl)benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C16H15ClN4O4S
MOLECULAR WEIGHT: 394.8327
SMILES: CC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC(=C3)Cl
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Product OPENEYE NAME: methyl 2-(4-methoxy-1H-benzimidazol-2-yl)-6-methyl-pyridine-3-carboxylate
CAS Name: 2-(4-methoxy-1H-benzimidazol-2-yl)-6-methyl-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-(4-methoxy-1H-benzimidazol-2-yl)-6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: methyl 2-(4-methoxy-1H-benzimidazol-2-yl)-6-methyl-pyridine-3-carboxylate
MOLECULAR FORMULA: C16H15N3O3
MOLECULAR WEIGHT: 297.3086
SMILES: CC1=NC(=C(C=C1)C(=O)OC)C2=NC3=C(N2)C=CC=C3OC
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-isopropoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-2-benzimidazolyl]-5-ethyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxybenzimidazol-2-yl]-5-ethylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C20H24N4O5S
MOLECULAR WEIGHT: 432.49336
SMILES: CCC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OC(C)C
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Product OPENEYE NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylate
CAS Name: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylate
IUPAC NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylate
SYSTEMATIC NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylate
MOLECULAR FORMULA: C20H19N4O4S-
MOLECULAR WEIGHT: 411.45426
SMILES: CC1=CC2=C(C=C1)N=C(N2)C3=C4CC(=CN(C4=CC=C3)S(=O)(=O)N(C)C)C(=O)[O-]
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Product OPENEYE NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylic acid
CAS Name: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylic acid
IUPAC NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylic acid
SYSTEMATIC NAME: 1-(dimethylsulfamoyl)-5-(6-methyl-1H-benzimidazol-2-yl)-4H-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C20H20N4O4S
MOLECULAR WEIGHT: 412.4622
SMILES: CC1=CC2=C(C=C1)N=C(N2)C3=C4CC(=CN(C4=CC=C3)S(=O)(=O)N(C)C)C(=O)O
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Product OPENEYE NAME: methyl 2-[1-(dimethylsulfamoyl)-1-methoxy-benzimidazol-1-ium-2-yl]-6-methyl-pyridine-3-carboxylate
CAS Name: 2-[1-(dimethylsulfamoyl)-1-methoxy-2-benzimidazol-1-iumyl]-6-methyl-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[1-(dimethylsulfamoyl)-1-methoxybenzimidazol-1-ium-2-yl]-6-methylpyridine-3-carboxylate
SYSTEMATIC NAME: methyl 2-[1-(dimethylsulfamoyl)-1-methoxy-benzimidazol-1-ium-2-yl]-6-methyl-pyridine-3-carboxylate
MOLECULAR FORMULA: C18H21N4O5S+
MOLECULAR WEIGHT: 405.44814
SMILES: CC1=NC(=C(C=C1)C(=O)OC)C2=NC3=CC=CC=C3[N+]2(OC)S(=O)(=O)N(C)C
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-methyl-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-methylbenzimidazol-2-yl]-5-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C17H18N4O4S
MOLECULAR WEIGHT: 374.41422
SMILES: CC1=C2C(=CC=C1)N(C(=N2)C3=NC=C(C=C3C(=O)O)C)S(=O)(=O)N(C)C
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-isopropoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxybenzimidazol-2-yl]-6-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-propan-2-yloxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C19H22N4O5S
MOLECULAR WEIGHT: 418.46678
SMILES: CC1=NC(=C(C=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OC(C)C
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Product OPENEYE NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[1-(dimethylsulfamoyl)-4-propoxy-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxybenzimidazol-2-yl]-5-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[1-(dimethylsulfamoyl)-4-propoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C19H22N4O5S
MOLECULAR WEIGHT: 418.46678
SMILES: CCCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=NC=C(C=C3C(=O)O)C
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Product OPENEYE NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylate; isopropylammonium
CAS Name: 2-[5-chloro-1-(dimethylsulfamoyl)-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylate; propan-2-ylammonium
IUPAC NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methylpyridine-3-carboxylate; propan-2-ylazanium
SYSTEMATIC NAME: 2-[5-chloranyl-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylate; propan-2-ylazanium
MOLECULAR FORMULA: C19H24ClN5O4S
MOLECULAR WEIGHT: 453.94296
SMILES: CC1=NC(=C(C=C1)C(=O)[O-])C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC(=C3)Cl.CC(C)[NH3+]
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Product OPENEYE NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
CAS Name: 2-[5-chloro-1-(dimethylsulfamoyl)-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylic acid
IUPAC NAME: 2-[5-chloro-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[5-chloranyl-1-(dimethylsulfamoyl)benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C16H15ClN4O4S
MOLECULAR WEIGHT: 394.8327
SMILES: CC1=NC(=C(C=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC(=C3)Cl
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