Thursday, November 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[[2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]acetyl]amino]-3-(3,5-dichlorophenyl)urea
CAS Name: 1-[[2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propylthio]-1-oxoethyl]amino]-3-(3,5-dichlorophenyl)urea
IUPAC NAME: 1-[[2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]acetyl]amino]-3-(3,5-dichlorophenyl)urea
SYSTEMATIC NAME: 1-[3,5-bis(chloranyl)phenyl]-3-[2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]ethanoylamino]urea
MOLECULAR FORMULA: C22H26Cl3N5O2S
MOLECULAR WEIGHT: 530.89814
SMILES: C1CN(CCN1CCCSCC(=O)NNC(=O)NC2=CC(=CC(=C2)Cl)Cl)C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: phenyl-(4-pyrrol-1-yl-1-piperidyl)methanone
CAS Name: phenyl-[4-(1-pyrrolyl)-1-piperidinyl]methanone
IUPAC NAME: phenyl-(4-pyrrol-1-ylpiperidin-1-yl)methanone
SYSTEMATIC NAME: phenyl-(4-pyrrol-1-ylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C16H18N2O
MOLECULAR WEIGHT: 254.32692
SMILES: C1CN(CCC1N2C=CC=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2-chlorophenyl)-(4-pyrrol-1-yl-1-piperidyl)methanone
CAS Name: (2-chlorophenyl)-[4-(1-pyrrolyl)-1-piperidinyl]methanone
IUPAC NAME: (2-chlorophenyl)-(4-pyrrol-1-ylpiperidin-1-yl)methanone
SYSTEMATIC NAME: (2-chlorophenyl)-(4-pyrrol-1-ylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C16H17ClN2O
MOLECULAR WEIGHT: 288.77198
SMILES: C1CN(CCC1N2C=CC=C2)C(=O)C3=CC=CC=C3Cl
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Product OPENEYE NAME: (4-pyrrol-1-yl-1-piperidyl)-(2-thienyl)methanone
CAS Name: [4-(1-pyrrolyl)-1-piperidinyl]-thiophen-2-ylmethanone
IUPAC NAME: (4-pyrrol-1-ylpiperidin-1-yl)-thiophen-2-ylmethanone
SYSTEMATIC NAME: (4-pyrrol-1-ylpiperidin-1-yl)-thiophen-2-yl-methanone
MOLECULAR FORMULA: C14H16N2OS
MOLECULAR WEIGHT: 260.35464
SMILES: C1CN(CCC1N2C=CC=C2)C(=O)C3=CC=CS3
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Product OPENEYE NAME: 1-(benzenesulfonyl)-4-pyrrol-1-yl-piperidine
CAS Name: 1-(benzenesulfonyl)-4-(1-pyrrolyl)piperidine
IUPAC NAME: 1-(benzenesulfonyl)-4-pyrrol-1-ylpiperidine
SYSTEMATIC NAME: 1-(phenylsulfonyl)-4-pyrrol-1-yl-piperidine
MOLECULAR FORMULA: C15H18N2O2S
MOLECULAR WEIGHT: 290.38062
SMILES: C1CN(CCC1N2C=CC=C2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 4-pyrrol-1-yl-1-(2-thienylsulfonyl)piperidine
CAS Name: 4-(1-pyrrolyl)-1-thiophen-2-ylsulfonylpiperidine
IUPAC NAME: 4-pyrrol-1-yl-1-thiophen-2-ylsulfonylpiperidine
SYSTEMATIC NAME: 4-pyrrol-1-yl-1-thiophen-2-ylsulfonyl-piperidine
MOLECULAR FORMULA: C13H16N2O2S2
MOLECULAR WEIGHT: 296.40834
SMILES: C1CN(CCC1N2C=CC=C2)S(=O)(=O)C3=CC=CS3
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Product OPENEYE NAME: 1-(4-chlorophenyl)sulfonyl-4-pyrrol-1-yl-piperidine
CAS Name: 1-(4-chlorophenyl)sulfonyl-4-(1-pyrrolyl)piperidine
IUPAC NAME: 1-(4-chlorophenyl)sulfonyl-4-pyrrol-1-ylpiperidine
SYSTEMATIC NAME: 1-(4-chlorophenyl)sulfonyl-4-pyrrol-1-yl-piperidine
MOLECULAR FORMULA: C15H17ClN2O2S
MOLECULAR WEIGHT: 324.82568
SMILES: C1CN(CCC1N2C=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: tert-butyl 3-(phenylcarbamoylamino)benzoate
CAS Name: 3-[[anilino(oxo)methyl]amino]benzoic acid tert-butyl ester
IUPAC NAME: tert-butyl 3-(phenylcarbamoylamino)benzoate
SYSTEMATIC NAME: tert-butyl 3-(phenylcarbamoylamino)benzoate
MOLECULAR FORMULA: C18H20N2O3
MOLECULAR WEIGHT: 312.363
SMILES: CC(C)(C)OC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: tert-butyl 3-[[4-(trifluoromethoxy)phenyl]carbamoylamino]benzoate
CAS Name: 3-[[oxo-[4-(trifluoromethoxy)anilino]methyl]amino]benzoic acid tert-butyl ester
IUPAC NAME: tert-butyl 3-[[4-(trifluoromethoxy)phenyl]carbamoylamino]benzoate
SYSTEMATIC NAME: tert-butyl 3-[[4-(trifluoromethyloxy)phenyl]carbamoylamino]benzoate
MOLECULAR FORMULA: C19H19F3N2O4
MOLECULAR WEIGHT: 396.36037
SMILES: CC(C)(C)OC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)OC(F)(F)F
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Product OPENEYE NAME: 3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole
CAS Name: 3-[2-(4-fluorophenyl)sulfonylethylthio]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole
IUPAC NAME: 3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole
SYSTEMATIC NAME: 3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole
MOLECULAR FORMULA: C12H11F4N3O2S2
MOLECULAR WEIGHT: 369.358253
SMILES: CN1C(=NN=C1SCCS(=O)(=O)C2=CC=C(C=C2)F)C(F)(F)F
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Product OPENEYE NAME: N-(4-chlorophenyl)-4-pyrrol-1-yl-piperidine-1-carboxamide
CAS Name: N-(4-chlorophenyl)-4-(1-pyrrolyl)-1-piperidinecarboxamide
IUPAC NAME: N-(4-chlorophenyl)-4-pyrrol-1-ylpiperidine-1-carboxamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-4-pyrrol-1-yl-piperidine-1-carboxamide
MOLECULAR FORMULA: C16H18ClN3O
MOLECULAR WEIGHT: 303.78662
SMILES: C1CN(CCC1N2C=CC=C2)C(=O)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-(3,5-dichlorophenyl)-4-pyrrol-1-yl-piperidine-1-carboxamide
CAS Name: N-(3,5-dichlorophenyl)-4-(1-pyrrolyl)-1-piperidinecarboxamide
IUPAC NAME: N-(3,5-dichlorophenyl)-4-pyrrol-1-ylpiperidine-1-carboxamide
SYSTEMATIC NAME: N-[3,5-bis(chloranyl)phenyl]-4-pyrrol-1-yl-piperidine-1-carboxamide
MOLECULAR FORMULA: C16H17Cl2N3O
MOLECULAR WEIGHT: 338.23168
SMILES: C1CN(CCC1N2C=CC=C2)C(=O)NC3=CC(=CC(=C3)Cl)Cl
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Product OPENEYE NAME: 3-[(4-fluorophenyl)sulfonylmethyl]-5-(2-thienyl)-1,2,4-oxadiazole
CAS Name: 3-[(4-fluorophenyl)sulfonylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole
IUPAC NAME: 3-[(4-fluorophenyl)sulfonylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-[(4-fluorophenyl)sulfonylmethyl]-5-thiophen-2-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C13H9FN2O3S2
MOLECULAR WEIGHT: 324.350563
SMILES: C1=CSC(=C1)C2=NC(=NO2)CS(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-butyl-4-pyrrol-1-yl-piperidine-1-carboxamide
CAS Name: N-butyl-4-(1-pyrrolyl)-1-piperidinecarboxamide
IUPAC NAME: N-butyl-4-pyrrol-1-ylpiperidine-1-carboxamide
SYSTEMATIC NAME: N-butyl-4-pyrrol-1-yl-piperidine-1-carboxamide
MOLECULAR FORMULA: C14H23N3O
MOLECULAR WEIGHT: 249.35192
SMILES: CCCCNC(=O)N1CCC(CC1)N2C=CC=C2
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Product OPENEYE NAME: 1-phenyl-3-[5-(2-phenylethynyl)-3-pyridyl]urea
CAS Name: 1-phenyl-3-[5-(2-phenylethynyl)-3-pyridinyl]urea
IUPAC NAME: 1-phenyl-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
SYSTEMATIC NAME: 1-phenyl-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
MOLECULAR FORMULA: C20H15N3O
MOLECULAR WEIGHT: 313.3526
SMILES: C1=CC=C(C=C1)C#CC2=CC(=CN=C2)NC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 3-chloro-2-(4-pyrrol-1-yl-1-piperidyl)-5-(trifluoromethyl)pyridine
CAS Name: 3-chloro-2-[4-(1-pyrrolyl)-1-piperidinyl]-5-(trifluoromethyl)pyridine
IUPAC NAME: 3-chloro-2-(4-pyrrol-1-ylpiperidin-1-yl)-5-(trifluoromethyl)pyridine
SYSTEMATIC NAME: 3-chloranyl-2-(4-pyrrol-1-ylpiperidin-1-yl)-5-(trifluoromethyl)pyridine
MOLECULAR FORMULA: C15H15ClF3N3
MOLECULAR WEIGHT: 329.74791
SMILES: C1CN(CCC1N2C=CC=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl
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