Monday, May 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-(2-phenylethoxy)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
CAS Name: N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-3-(2-phenylethoxy)benzamide
IUPAC NAME: 3-(2-phenylethoxy)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 3-(2-phenylethoxy)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C27H27N3O3S
MOLECULAR WEIGHT: 473.58658
SMILES: C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4
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Product OPENEYE NAME: 3-(2-ethoxyethoxy)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
CAS Name: 3-(2-ethoxyethoxy)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]benzamide
IUPAC NAME: 3-(2-ethoxyethoxy)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 3-(2-ethoxyethoxy)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C23H27N3O4S
MOLECULAR WEIGHT: 441.54318
SMILES: CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: 3-isobutoxy-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
CAS Name: 3-(2-methylpropoxy)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]benzamide
IUPAC NAME: 3-(2-methylpropoxy)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 3-(2-methylpropoxy)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C23H27N3O3S
MOLECULAR WEIGHT: 425.54378
SMILES: CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine
CAS Name: 3-(2-bromophenyl)-5-(propylthio)-1,2,4-triazol-4-amine
IUPAC NAME: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine
SYSTEMATIC NAME: 3-(2-bromophenyl)-5-propylsulfanyl-1,2,4-triazol-4-amine
MOLECULAR FORMULA: C11H13BrN4S
MOLECULAR WEIGHT: 313.21672
SMILES: CCCSC1=NN=C(N1N)C2=CC=CC=C2Br
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Product OPENEYE NAME: (2R)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(isobutylcarbamoyl)propanamide
CAS Name: (2R)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide
IUPAC NAME: (2R)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide
SYSTEMATIC NAME: (2R)-2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide
MOLECULAR FORMULA: C16H21BrN6O2S
MOLECULAR WEIGHT: 441.34594
SMILES: C[C@H](C(=O)NC(=O)NCC(C)C)SC1=NN=C(N1N)C2=CC=CC=C2Br
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Product OPENEYE NAME: (2S)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(isobutylcarbamoyl)propanamide
CAS Name: (2S)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide
IUPAC NAME: (2S)-2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide
SYSTEMATIC NAME: (2S)-2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)propanamide
MOLECULAR FORMULA: C16H21BrN6O2S
MOLECULAR WEIGHT: 441.34594
SMILES: C[C@@H](C(=O)NC(=O)NCC(C)C)SC1=NN=C(N1N)C2=CC=CC=C2Br
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Product OPENEYE NAME: 3-isopropoxy-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
CAS Name: N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-3-propan-2-yloxybenzamide
IUPAC NAME: 3-propan-2-yloxy-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 3-propan-2-yloxy-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C22H25N3O3S
MOLECULAR WEIGHT: 411.5172
SMILES: CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: (E)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]-3-(2-thienyl)prop-2-enamide
CAS Name: (E)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide
IUPAC NAME: (E)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide
SYSTEMATIC NAME: (E)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide
MOLECULAR FORMULA: C19H19N3O2S2
MOLECULAR WEIGHT: 385.50306
SMILES: C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CS3
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Product OPENEYE NAME: methyl 3-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioylcarbamoyl]benzoate
CAS Name: 3-[oxo-[[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]amino]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioylcarbamoyl]benzoate
SYSTEMATIC NAME: methyl 3-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioylcarbamoyl]benzoate
MOLECULAR FORMULA: C21H21N3O4S
MOLECULAR WEIGHT: 411.47414
SMILES: COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: (E)-3-(3-nitrophenyl)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide
CAS Name: (E)-3-(3-nitrophenyl)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-2-propenamide
IUPAC NAME: (E)-3-(3-nitrophenyl)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3-nitrophenyl)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide
MOLECULAR FORMULA: C21H20N4O4S
MOLECULAR WEIGHT: 424.4729
SMILES: C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-isopropyl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
CAS Name: N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide
IUPAC NAME: 4-propan-2-yl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 4-propan-2-yl-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C22H25N3O2S
MOLECULAR WEIGHT: 395.5178
SMILES: CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: (E)-3-(1-naphthyl)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide
CAS Name: (E)-3-(1-naphthalenyl)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]-2-propenamide
IUPAC NAME: (E)-3-naphthalen-1-yl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide
SYSTEMATIC NAME: (E)-3-naphthalen-1-yl-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide
MOLECULAR FORMULA: C25H23N3O2S
MOLECULAR WEIGHT: 429.53402
SMILES: C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43
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Product OPENEYE NAME: methyl 4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioylcarbamoyl]benzoate
CAS Name: 4-[oxo-[[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]amino]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioylcarbamoyl]benzoate
SYSTEMATIC NAME: methyl 4-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioylcarbamoyl]benzoate
MOLECULAR FORMULA: C21H21N3O4S
MOLECULAR WEIGHT: 411.47414
SMILES: COC(=O)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCCC3
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Product OPENEYE NAME: 3-(2-chlorophenyl)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]propanamide
CAS Name: 3-(2-chlorophenyl)-N-[[3-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]propanamide
IUPAC NAME: 3-(2-chlorophenyl)-N-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]propanamide
SYSTEMATIC NAME: 3-(2-chlorophenyl)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]propanamide
MOLECULAR FORMULA: C21H22ClN3O2S
MOLECULAR WEIGHT: 415.93628
SMILES: C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl
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