Friday, November 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 5-(4-chlorophenyl)-4-nitroso-2-phenyl-pyrazol-3-amine
CAS Name: 5-(4-chlorophenyl)-4-nitroso-2-phenyl-3-pyrazolamine
IUPAC NAME: 5-(4-chlorophenyl)-4-nitroso-2-phenylpyrazol-3-amine
SYSTEMATIC NAME: 5-(4-chlorophenyl)-4-nitroso-2-phenyl-pyrazol-3-amine
MOLECULAR FORMULA: C15H11ClN4O
MOLECULAR WEIGHT: 298.72704
SMILES: C1=CC=C(C=C1)N2C(=C(C(=N2)C3=CC=C(C=C3)Cl)N=O)N
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Product OPENEYE NAME: N'-(thiophene-2-carbonyl)-2,1,3-benzoxadiazole-5-carbohydrazide
CAS Name: N'-[oxo(thiophen-2-yl)methyl]-2,1,3-benzoxadiazole-5-carbohydrazide
IUPAC NAME: N'-(thiophene-2-carbonyl)-2,1,3-benzoxadiazole-5-carbohydrazide
SYSTEMATIC NAME: N'-thiophen-2-ylcarbonyl-2,1,3-benzoxadiazole-5-carbohydrazide
MOLECULAR FORMULA: C12H8N4O3S
MOLECULAR WEIGHT: 288.28192
SMILES: C1=CSC(=C1)C(=O)NNC(=O)C2=CC3=NON=C3C=C2
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Product OPENEYE NAME: N'-(4-chlorobenzoyl)-2,1,3-benzoxadiazole-5-carbohydrazide
CAS Name: N'-[(4-chlorophenyl)-oxomethyl]-2,1,3-benzoxadiazole-5-carbohydrazide
IUPAC NAME: N'-(4-chlorobenzoyl)-2,1,3-benzoxadiazole-5-carbohydrazide
SYSTEMATIC NAME: N'-(4-chlorophenyl)carbonyl-2,1,3-benzoxadiazole-5-carbohydrazide
MOLECULAR FORMULA: C14H9ClN4O3
MOLECULAR WEIGHT: 316.69926
SMILES: C1=CC(=CC=C1C(=O)NNC(=O)C2=CC3=NON=C3C=C2)Cl
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Product OPENEYE NAME: 1-(2,1,3-benzoxadiazole-5-carbonylamino)-3-methyl-thiourea
CAS Name: 1-[[2,1,3-benzoxadiazol-5-yl(oxo)methyl]amino]-3-methylthiourea
IUPAC NAME: 1-(2,1,3-benzoxadiazole-5-carbonylamino)-3-methylthiourea
SYSTEMATIC NAME: 1-(2,1,3-benzoxadiazol-5-ylcarbonylamino)-3-methyl-thiourea
MOLECULAR FORMULA: C9H9N5O2S
MOLECULAR WEIGHT: 251.26506
SMILES: CNC(=S)NNC(=O)C1=CC2=NON=C2C=C1
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Product OPENEYE NAME: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-propylsulfonyl-pyrimidin-4-amine
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-propylsulfonyl-4-pyrimidinamine
IUPAC NAME: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-propylsulfonylpyrimidin-4-amine
SYSTEMATIC NAME: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-propylsulfonyl-pyrimidin-4-amine
MOLECULAR FORMULA: C15H17N3O4S
MOLECULAR WEIGHT: 335.37818
SMILES: CCCS(=O)(=O)C1=CN=C(N=C1N)C2COC3=CC=CC=C3O2
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Product OPENEYE NAME: 3-(2,1,3-benzoxadiazol-5-yl)-4-methyl-1H-1,2,4-triazole-5-thione
CAS Name: 3-(2,1,3-benzoxadiazol-5-yl)-4-methyl-1H-1,2,4-triazole-5-thione
IUPAC NAME: 3-(2,1,3-benzoxadiazol-5-yl)-4-methyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-(2,1,3-benzoxadiazol-5-yl)-4-methyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C9H7N5OS
MOLECULAR WEIGHT: 233.24978
SMILES: CN1C(=NNC1=S)C2=CC3=NON=C3C=C2
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Product OPENEYE NAME: 1-benzyl-3-(o-tolyl)urea
CAS Name: 1-(2-methylphenyl)-3-(phenylmethyl)urea
IUPAC NAME: 1-benzyl-3-(2-methylphenyl)urea
SYSTEMATIC NAME: 1-(2-methylphenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C15H16N2O
MOLECULAR WEIGHT: 240.30034
SMILES: CC1=CC=CC=C1NC(=O)NCC2=CC=CC=C2
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Product OPENEYE NAME: 1-(o-tolyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
CAS Name: 1-(2-methylphenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
IUPAC NAME: 1-(2-methylphenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
SYSTEMATIC NAME: 1-(2-methylphenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
MOLECULAR FORMULA: C16H15F3N2O
MOLECULAR WEIGHT: 308.29831
SMILES: CC1=CC=CC=C1NC(=O)NCC2=CC=CC=C2C(F)(F)F
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Product OPENEYE NAME: 6-amino-3-benzyl-1-phenyl-pyrimidine-2,4-dione
CAS Name: 6-amino-1-phenyl-3-(phenylmethyl)pyrimidine-2,4-dione
IUPAC NAME: 6-amino-3-benzyl-1-phenylpyrimidine-2,4-dione
SYSTEMATIC NAME: 6-azanyl-1-phenyl-3-(phenylmethyl)pyrimidine-2,4-dione
MOLECULAR FORMULA: C17H15N3O2
MOLECULAR WEIGHT: 293.3199
SMILES: C1=CC=C(C=C1)CN2C(=O)C=C(N(C2=O)C3=CC=CC=C3)N
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Product OPENEYE NAME: 5-(benzenesulfonyl)-2-(2,3-dihydro-1,4-benzodioxin-3-yl)pyrimidin-4-amine
CAS Name: 5-(benzenesulfonyl)-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-pyrimidinamine
IUPAC NAME: 5-(benzenesulfonyl)-2-(2,3-dihydro-1,4-benzodioxin-3-yl)pyrimidin-4-amine
SYSTEMATIC NAME: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-(phenylsulfonyl)pyrimidin-4-amine
MOLECULAR FORMULA: C18H15N3O4S
MOLECULAR WEIGHT: 369.3944
SMILES: C1C(OC2=CC=CC=C2O1)C3=NC=C(C(=N3)N)S(=O)(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)pyrimidin-4-amine
CAS Name: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-pyrimidinamine
IUPAC NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)pyrimidin-4-amine
SYSTEMATIC NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)pyrimidin-4-amine
MOLECULAR FORMULA: C18H14ClN3O4S
MOLECULAR WEIGHT: 403.83946
SMILES: C1C(OC2=CC=CC=C2O1)C3=NC=C(C(=N3)N)S(=O)(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 1-(o-tolyl)-3-(2-thienylmethyl)urea
CAS Name: 1-(2-methylphenyl)-3-(thiophen-2-ylmethyl)urea
IUPAC NAME: 1-(2-methylphenyl)-3-(thiophen-2-ylmethyl)urea
SYSTEMATIC NAME: 1-(2-methylphenyl)-3-(thiophen-2-ylmethyl)urea
MOLECULAR FORMULA: C13H14N2OS
MOLECULAR WEIGHT: 246.32806
SMILES: CC1=CC=CC=C1NC(=O)NCC2=CC=CS2
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Product OPENEYE NAME: 6-amino-3-benzyl-1-(4-chlorophenyl)pyrimidine-2,4-dione
CAS Name: 6-amino-1-(4-chlorophenyl)-3-(phenylmethyl)pyrimidine-2,4-dione
IUPAC NAME: 6-amino-3-benzyl-1-(4-chlorophenyl)pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-azanyl-1-(4-chlorophenyl)-3-(phenylmethyl)pyrimidine-2,4-dione
MOLECULAR FORMULA: C17H14ClN3O2
MOLECULAR WEIGHT: 327.76496
SMILES: C1=CC=C(C=C1)CN2C(=O)C=C(N(C2=O)C3=CC=C(C=C3)Cl)N
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Product OPENEYE NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-pyrimidine
CAS Name: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methylpyrimidine
IUPAC NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methylpyrimidine
SYSTEMATIC NAME: 5-(4-chlorophenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-pyrimidine
MOLECULAR FORMULA: C19H15ClN2O4S
MOLECULAR WEIGHT: 402.8514
SMILES: CC1=NC(=NC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)C3COC4=CC=CC=C4O3
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