Saturday, November 3, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]-3-(4-fluorophenyl)urea
CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]-3-(4-fluorophenyl)urea
IUPAC NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]-3-(4-fluorophenyl)urea
SYSTEMATIC NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]-3-(4-fluorophenyl)urea
MOLECULAR FORMULA: C19H14FN3OS2
MOLECULAR WEIGHT: 383.462363
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)NC4=CC=C(C=C4)F
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Product OPENEYE NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]-3-(4-tert-butylphenyl)urea
CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]-3-(4-tert-butylphenyl)urea
IUPAC NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]-3-(4-tert-butylphenyl)urea
SYSTEMATIC NAME: 1-[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]-3-(4-tert-butylphenyl)urea
MOLECULAR FORMULA: C23H23N3OS2
MOLECULAR WEIGHT: 421.57822
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)NC4=CC=C(C=C4)C(C)(C)C
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Product OPENEYE NAME: 2-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]carbamoyl]benzoic acid
CAS Name: 2-[[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]amino]-oxomethyl]benzoic acid
IUPAC NAME: 2-[[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]carbamoyl]benzoic acid
SYSTEMATIC NAME: 2-[[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]carbamoyl]benzoic acid
MOLECULAR FORMULA: C20H14N2O3S2
MOLECULAR WEIGHT: 394.46676
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4C(=O)O
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Product OPENEYE NAME: 2-[2-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]amino]-2-oxo-ethoxy]acetic acid
CAS Name: 2-[2-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]amino]-2-oxoethoxy]acetic acid
IUPAC NAME: 2-[2-[[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]amino]-2-oxoethoxy]acetic acid
SYSTEMATIC NAME: 2-[2-[[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethoxy]ethanoic acid
MOLECULAR FORMULA: C16H14N2O4S2
MOLECULAR WEIGHT: 362.42336
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)COCC(=O)O
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Product OPENEYE NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]amino]-3,3-dimethyl-5-oxo-pentanoic acid
CAS Name: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]amino]-3,3-dimethyl-5-oxopentanoic acid
IUPAC NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]amino]-3,3-dimethyl-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C19H20N2O3S2
MOLECULAR WEIGHT: 388.5037
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)CC(C)(C)CC(=O)O
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Product OPENEYE NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]amino]-5-oxo-pentanoic acid
CAS Name: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]amino]-5-oxopentanoic acid
IUPAC NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C17H16N2O3S2
MOLECULAR WEIGHT: 360.45054
SMILES: CC1=CSC(=C1C2=NC3=CC=CC=C3S2)NC(=O)CCCC(=O)O
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Product OPENEYE NAME: 5-methyl-4-[[4-[(5-methyl-3-phenyl-isoxazol-4-yl)methyl]piperazin-1-yl]methyl]-3-phenyl-isoxazole
CAS Name: 5-methyl-4-[[4-[(5-methyl-3-phenyl-4-isoxazolyl)methyl]-1-piperazinyl]methyl]-3-phenylisoxazole
IUPAC NAME: 5-methyl-4-[[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]methyl]-3-phenyl-1,2-oxazole
SYSTEMATIC NAME: 5-methyl-4-[[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]methyl]-3-phenyl-1,2-oxazole
MOLECULAR FORMULA: C26H28N4O2
MOLECULAR WEIGHT: 428.52612
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)CN3CCN(CC3)CC4=C(ON=C4C5=CC=CC=C5)C
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Product OPENEYE NAME: N-(4-tert-butylphenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
CAS Name: N-(4-tert-butylphenyl)-4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepane-1-carboxamide
IUPAC NAME: N-(4-tert-butylphenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
SYSTEMATIC NAME: N-(4-tert-butylphenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
MOLECULAR FORMULA: C21H26F3N5O
MOLECULAR WEIGHT: 421.45925
SMILES: CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: N-phenyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
CAS Name: N-phenyl-4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepane-1-carboxamide
IUPAC NAME: N-phenyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
SYSTEMATIC NAME: N-phenyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepane-1-carboxamide
MOLECULAR FORMULA: C17H18F3N5O
MOLECULAR WEIGHT: 365.35293
SMILES: C1CN(CCN(C1)C(=O)NC2=CC=CC=C2)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: (4-chlorophenyl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
CAS Name: (4-chlorophenyl)-[4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepan-1-yl]methanone
IUPAC NAME: (4-chlorophenyl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
SYSTEMATIC NAME: (4-chlorophenyl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
MOLECULAR FORMULA: C17H16ClF3N4O
MOLECULAR WEIGHT: 384.78335
SMILES: C1CN(CCN(C1)C(=O)C2=CC=C(C=C2)Cl)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: phenyl-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
CAS Name: phenyl-[4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepan-1-yl]methanone
IUPAC NAME: phenyl-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
SYSTEMATIC NAME: phenyl-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
MOLECULAR FORMULA: C17H17F3N4O
MOLECULAR WEIGHT: 350.33829
SMILES: C1CN(CCN(C1)C(=O)C2=CC=CC=C2)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: (3-chloro-2-thienyl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
CAS Name: (3-chloro-2-thiophenyl)-[4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepan-1-yl]methanone
IUPAC NAME: (3-chlorothiophen-2-yl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
SYSTEMATIC NAME: (3-chloranylthiophen-2-yl)-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]methanone
MOLECULAR FORMULA: C15H14ClF3N4OS
MOLECULAR WEIGHT: 390.81107
SMILES: C1CN(CCN(C1)C(=O)C2=C(C=CS2)Cl)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: ethyl 5-[(4-fluorophenyl)sulfonylamino]-2-(1-piperidyl)benzoate
CAS Name: 5-[(4-fluorophenyl)sulfonylamino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-[(4-fluorophenyl)sulfonylamino]-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[(4-fluorophenyl)sulfonylamino]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C20H23FN2O4S
MOLECULAR WEIGHT: 406.471023
SMILES: CCOC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)N3CCCCC3
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