Friday, November 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyleneamino]acetamide
CAS Name: 2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-N-[[3-(trifluoromethyl)phenyl]methylideneamino]acetamide
IUPAC NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[[3-(trifluoromethyl)phenyl]methylideneamino]acetamide
SYSTEMATIC NAME: 2-[1-(diphenylmethyl)azetidin-3-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methylideneamino]ethanamide
MOLECULAR FORMULA: C26H24F3N3OS
MOLECULAR WEIGHT: 483.54847
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=CC=C4)C(F)(F)F
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Product OPENEYE NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[[4-(trifluoromethoxy)phenyl]methyleneamino]acetamide
CAS Name: 2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-N-[[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide
IUPAC NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide
SYSTEMATIC NAME: 2-[1-(diphenylmethyl)azetidin-3-yl]sulfanyl-N-[[4-(trifluoromethyloxy)phenyl]methylideneamino]ethanamide
MOLECULAR FORMULA: C26H24F3N3O2S
MOLECULAR WEIGHT: 499.54787
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NN=CC4=CC=C(C=C4)OC(F)(F)F
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Product OPENEYE NAME: 3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-5-oct-1-ynyl-pyridine
CAS Name: 3-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]-5-oct-1-ynylpyridine
IUPAC NAME: 3-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-5-oct-1-ynylpyridine
SYSTEMATIC NAME: 3-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]-5-oct-1-ynyl-pyridine
MOLECULAR FORMULA: C23H26N4S
MOLECULAR WEIGHT: 390.54434
SMILES: CCCCCCC#CC1=CC(=CN=C1)C2=NN=C(N2C)SCC3=CC=CC=C3
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Product OPENEYE NAME: 3-[5-[(2,6-dichlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynyl-pyridine
CAS Name: 3-[5-[(2,6-dichlorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynylpyridine
IUPAC NAME: 3-[5-[(2,6-dichlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynylpyridine
SYSTEMATIC NAME: 3-[5-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynyl-pyridine
MOLECULAR FORMULA: C23H24Cl2N4S
MOLECULAR WEIGHT: 459.43446
SMILES: CCCCCCC#CC1=CC(=CN=C1)C2=NN=C(N2C)SCC3=C(C=CC=C3Cl)Cl
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Product OPENEYE NAME: N-[3-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-5-carboxamide
CAS Name: N-[3-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-5-carboxamide
IUPAC NAME: N-[3-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-5-carboxamide
SYSTEMATIC NAME: N-[3-(trifluoromethyl)phenyl]-2,1,3-benzoxadiazole-5-carboxamide
MOLECULAR FORMULA: C14H8F3N3O2
MOLECULAR WEIGHT: 307.22743
SMILES: C1=CC(=CC(=C1)NC(=O)C2=CC3=NON=C3C=C2)C(F)(F)F
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Product OPENEYE NAME: N-(4-chlorophenyl)-2,1,3-benzoxadiazole-5-carboxamide
CAS Name: N-(4-chlorophenyl)-2,1,3-benzoxadiazole-5-carboxamide
IUPAC NAME: N-(4-chlorophenyl)-2,1,3-benzoxadiazole-5-carboxamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-2,1,3-benzoxadiazole-5-carboxamide
MOLECULAR FORMULA: C13H8ClN3O2
MOLECULAR WEIGHT: 273.67452
SMILES: C1=CC(=CC=C1NC(=O)C2=CC3=NON=C3C=C2)Cl
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Product OPENEYE NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[(4-tert-butylphenyl)methyleneamino]acetamide
CAS Name: N-[(4-tert-butylphenyl)methylideneamino]-2-[[1-(diphenylmethyl)-3-azetidinyl]thio]acetamide
IUPAC NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-[(4-tert-butylphenyl)methylideneamino]acetamide
SYSTEMATIC NAME: N-[(4-tert-butylphenyl)methylideneamino]-2-[1-(diphenylmethyl)azetidin-3-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C29H33N3OS
MOLECULAR WEIGHT: 471.65682
SMILES: CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)CSC2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: [[amino-[3-(cyclopentoxy)-4-methoxy-phenyl]methylene]amino] N-(4-chlorophenyl)carbamate
CAS Name: N-(4-chlorophenyl)carbamic acid [[amino-(3-cyclopentyloxy-4-methoxyphenyl)methylidene]amino] ester
IUPAC NAME: [[amino-(3-cyclopentyloxy-4-methoxyphenyl)methylidene]amino] N-(4-chlorophenyl)carbamate
SYSTEMATIC NAME: [[azanyl-(3-cyclopentyloxy-4-methoxy-phenyl)methylidene]amino] N-(4-chlorophenyl)carbamate
MOLECULAR FORMULA: C20H22ClN3O4
MOLECULAR WEIGHT: 403.85938
SMILES: COC1=C(C=C(C=C1)C(=NOC(=O)NC2=CC=C(C=C2)Cl)N)OC3CCCC3
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Product OPENEYE NAME: 3-[5-[(3,5-difluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynyl-pyridine
CAS Name: 3-[5-[(3,5-difluorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynylpyridine
IUPAC NAME: 3-[5-[(3,5-difluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynylpyridine
SYSTEMATIC NAME: 3-[5-[[3,5-bis(fluoranyl)phenyl]methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-5-oct-1-ynyl-pyridine
MOLECULAR FORMULA: C23H24F2N4S
MOLECULAR WEIGHT: 426.525266
SMILES: CCCCCCC#CC1=CC(=CN=C1)C2=NN=C(N2C)SCC3=CC(=CC(=C3)F)F
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Product OPENEYE NAME: N-(5-oct-1-ynyl-3-pyridyl)-4-phenyl-piperazine-1-carboxamide
CAS Name: N-(5-oct-1-ynyl-3-pyridinyl)-4-phenyl-1-piperazinecarboxamide
IUPAC NAME: N-(5-oct-1-ynylpyridin-3-yl)-4-phenylpiperazine-1-carboxamide
SYSTEMATIC NAME: N-(5-oct-1-ynylpyridin-3-yl)-4-phenyl-piperazine-1-carboxamide
MOLECULAR FORMULA: C24H30N4O
MOLECULAR WEIGHT: 390.5212
SMILES: CCCCCCC#CC1=CC(=CN=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3
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Product OPENEYE NAME: (4-chlorophenyl) 2,1,3-benzoxadiazole-5-carboxylate
CAS Name: 2,1,3-benzoxadiazole-5-carboxylic acid (4-chlorophenyl) ester
IUPAC NAME: (4-chlorophenyl) 2,1,3-benzoxadiazole-5-carboxylate
SYSTEMATIC NAME: (4-chlorophenyl) 2,1,3-benzoxadiazole-5-carboxylate
MOLECULAR FORMULA: C13H7ClN2O3
MOLECULAR WEIGHT: 274.65928
SMILES: C1=CC(=CC=C1OC(=O)C2=CC3=NON=C3C=C2)Cl
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Product OPENEYE NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-(3-pyridylmethyleneamino)acetamide
CAS Name: 2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-N-(3-pyridinylmethylideneamino)acetamide
IUPAC NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-(pyridin-3-ylmethylideneamino)acetamide
SYSTEMATIC NAME: 2-[1-(diphenylmethyl)azetidin-3-yl]sulfanyl-N-(pyridin-3-ylmethylideneamino)ethanamide
MOLECULAR FORMULA: C24H24N4OS
MOLECULAR WEIGHT: 416.53856
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NN=CC4=CN=CC=C4
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Product OPENEYE NAME: (4-methoxyphenyl) 2,1,3-benzoxadiazole-5-carboxylate
CAS Name: 2,1,3-benzoxadiazole-5-carboxylic acid (4-methoxyphenyl) ester
IUPAC NAME: (4-methoxyphenyl) 2,1,3-benzoxadiazole-5-carboxylate
SYSTEMATIC NAME: (4-methoxyphenyl) 2,1,3-benzoxadiazole-5-carboxylate
MOLECULAR FORMULA: C14H10N2O4
MOLECULAR WEIGHT: 270.2402
SMILES: COC1=CC=C(C=C1)OC(=O)C2=CC3=NON=C3C=C2
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Product OPENEYE NAME: [3-(trifluoromethyl)phenyl] 2,1,3-benzoxadiazole-5-carboxylate
CAS Name: 2,1,3-benzoxadiazole-5-carboxylic acid [3-(trifluoromethyl)phenyl] ester
IUPAC NAME: [3-(trifluoromethyl)phenyl] 2,1,3-benzoxadiazole-5-carboxylate
SYSTEMATIC NAME: [3-(trifluoromethyl)phenyl] 2,1,3-benzoxadiazole-5-carboxylate
MOLECULAR FORMULA: C14H7F3N2O3
MOLECULAR WEIGHT: 308.21219
SMILES: C1=CC(=CC(=C1)OC(=O)C2=CC3=NON=C3C=C2)C(F)(F)F
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Product OPENEYE NAME: (2,3-difluorophenyl) 2,1,3-benzoxadiazole-5-carboxylate
CAS Name: 2,1,3-benzoxadiazole-5-carboxylic acid (2,3-difluorophenyl) ester
IUPAC NAME: (2,3-difluorophenyl) 2,1,3-benzoxadiazole-5-carboxylate
SYSTEMATIC NAME: [2,3-bis(fluoranyl)phenyl] 2,1,3-benzoxadiazole-5-carboxylate
MOLECULAR FORMULA: C13H6F2N2O3
MOLECULAR WEIGHT: 276.195146
SMILES: C1=CC(=C(C(=C1)F)F)OC(=O)C2=CC3=NON=C3C=C2
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Product OPENEYE NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-(2-pyridylmethyleneamino)acetamide
CAS Name: 2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-N-(2-pyridinylmethylideneamino)acetamide
IUPAC NAME: 2-(1-benzhydrylazetidin-3-yl)sulfanyl-N-(pyridin-2-ylmethylideneamino)acetamide
SYSTEMATIC NAME: 2-[1-(diphenylmethyl)azetidin-3-yl]sulfanyl-N-(pyridin-2-ylmethylideneamino)ethanamide
MOLECULAR FORMULA: C24H24N4OS
MOLECULAR WEIGHT: 416.53856
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NN=CC4=CC=CC=N4
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