Friday, May 17, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 4-(tetrazol-1-yl)-N'-[3-(2-thienyl)propanoyl]benzohydrazide
CAS Name: N'-(1-oxo-3-thiophen-2-ylpropyl)-4-(1-tetrazolyl)benzohydrazide
IUPAC NAME: 4-(tetrazol-1-yl)-N'-(3-thiophen-2-ylpropanoyl)benzohydrazide
SYSTEMATIC NAME: 4-(1,2,3,4-tetrazol-1-yl)-N'-(3-thiophen-2-ylpropanoyl)benzohydrazide
MOLECULAR FORMULA: C15H14N6O2S
MOLECULAR WEIGHT: 342.37566
SMILES: C1=CSC(=C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)N3C=NN=N3
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Product OPENEYE NAME: 4-cyclohexyl-N'-[4-(tetrazol-1-yl)benzoyl]benzohydrazide
CAS Name: 4-cyclohexyl-N'-[oxo-[4-(1-tetrazolyl)phenyl]methyl]benzohydrazide
IUPAC NAME: 4-cyclohexyl-N'-[4-(tetrazol-1-yl)benzoyl]benzohydrazide
SYSTEMATIC NAME: 4-cyclohexyl-N'-[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonyl-benzohydrazide
MOLECULAR FORMULA: C21H22N6O2
MOLECULAR WEIGHT: 390.43838
SMILES: C1CCC(CC1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)N4C=NN=N4
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Product OPENEYE NAME: (2R)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxy-propanamide
CAS Name: (2R)-N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-phenoxypropanamide
IUPAC NAME: (2R)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxypropanamide
SYSTEMATIC NAME: (2R)-N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxy-propanamide
MOLECULAR FORMULA: C21H27ClN3O2+
MOLECULAR WEIGHT: 388.91098
SMILES: CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)[C@@H](C)OC3=CC=CC=C3
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Product OPENEYE NAME: (2R)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxy-propanamide
CAS Name: (2R)-N-[5-chloro-2-(4-ethyl-1-piperazinyl)phenyl]-2-phenoxypropanamide
IUPAC NAME: (2R)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxypropanamide
SYSTEMATIC NAME: (2R)-N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxy-propanamide
MOLECULAR FORMULA: C21H26ClN3O2
MOLECULAR WEIGHT: 387.90304
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)[C@@H](C)OC3=CC=CC=C3
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Product OPENEYE NAME: (2S)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxy-propanamide
CAS Name: (2S)-N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-phenoxypropanamide
IUPAC NAME: (2S)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxypropanamide
SYSTEMATIC NAME: (2S)-N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-phenoxy-propanamide
MOLECULAR FORMULA: C21H27ClN3O2+
MOLECULAR WEIGHT: 388.91098
SMILES: CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)[C@H](C)OC3=CC=CC=C3
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Product OPENEYE NAME: (2S)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxy-propanamide
CAS Name: (2S)-N-[5-chloro-2-(4-ethyl-1-piperazinyl)phenyl]-2-phenoxypropanamide
IUPAC NAME: (2S)-N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxypropanamide
SYSTEMATIC NAME: (2S)-N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-2-phenoxy-propanamide
MOLECULAR FORMULA: C21H26ClN3O2
MOLECULAR WEIGHT: 387.90304
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)[C@H](C)OC3=CC=CC=C3
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Product OPENEYE NAME: (3S)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]-5-oxo-pyrrolidine-3-carbohydrazide
CAS Name: (3S)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)-1-oxoethyl]-5-oxo-3-pyrrolidinecarbohydrazide
IUPAC NAME: (3S)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]-5-oxopyrrolidine-3-carbohydrazide
SYSTEMATIC NAME: (3S)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)ethanoyl]-5-oxidanylidene-pyrrolidine-3-carbohydrazide
MOLECULAR FORMULA: C19H17F2N3O3
MOLECULAR WEIGHT: 373.353386
SMILES: C1[C@@H](CN(C1=O)C2=CC=CC=C2F)C(=O)NNC(=O)CC3=CC=C(C=C3)F
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Product OPENEYE NAME: (3R)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]-5-oxo-pyrrolidine-3-carbohydrazide
CAS Name: (3R)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)-1-oxoethyl]-5-oxo-3-pyrrolidinecarbohydrazide
IUPAC NAME: (3R)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]-5-oxopyrrolidine-3-carbohydrazide
SYSTEMATIC NAME: (3R)-1-(2-fluorophenyl)-N'-[2-(4-fluorophenyl)ethanoyl]-5-oxidanylidene-pyrrolidine-3-carbohydrazide
MOLECULAR FORMULA: C19H17F2N3O3
MOLECULAR WEIGHT: 373.353386
SMILES: C1[C@H](CN(C1=O)C2=CC=CC=C2F)C(=O)NNC(=O)CC3=CC=C(C=C3)F
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Product OPENEYE NAME: 3-(3,5-dimethylisoxazol-4-yl)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-1-propanone
IUPAC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
SYSTEMATIC NAME: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
MOLECULAR FORMULA: C19H21F3N4O4
MOLECULAR WEIGHT: 426.38965
SMILES: CC1=C(C(=NO1)C)CCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide
CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide
IUPAC NAME: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)ethanamide
MOLECULAR FORMULA: C16H16ClNO3S2
MOLECULAR WEIGHT: 369.88614
SMILES: C1COC2=C(O1)C=CC(=C2)CNC(=O)CSCC3=CC=C(S3)Cl
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Product OPENEYE NAME: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide
CAS Name: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide
IUPAC NAME: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-5-(cyclopropylsulfamoyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide
MOLECULAR FORMULA: C19H18Cl2N2O5S
MOLECULAR WEIGHT: 457.32762
SMILES: C1CC1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)Cl)Cl
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Product OPENEYE NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,5-dimethylisoxazol-4-yl)propanamide
CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,5-dimethyl-4-isoxazolyl)propanamide
IUPAC NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
SYSTEMATIC NAME: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
MOLECULAR FORMULA: C17H20N2O4
MOLECULAR WEIGHT: 316.3517
SMILES: CC1=C(C(=NO1)C)CCC(=O)NCC2=CC3=C(C=C2)OCCO3
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-2-dibenzofuran-2-yloxy-acetamide
CAS Name: 2-(2-dibenzofuranyloxy)-N-[2-(phenylmethyl)-3-pyrazolyl]acetamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-2-dibenzofuran-2-yloxyacetamide
SYSTEMATIC NAME: 2-dibenzofuran-2-yloxy-N-[2-(phenylmethyl)pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C24H19N3O3
MOLECULAR WEIGHT: 397.42596
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)COC3=CC4=C(C=C3)OC5=CC=CC=C54
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Product OPENEYE NAME: 2-(4-anilinophenoxy)-N-(2-benzylpyrazol-3-yl)acetamide
CAS Name: 2-(4-anilinophenoxy)-N-[2-(phenylmethyl)-3-pyrazolyl]acetamide
IUPAC NAME: 2-(4-anilinophenoxy)-N-(2-benzylpyrazol-3-yl)acetamide
SYSTEMATIC NAME: 2-(4-phenylazanylphenoxy)-N-[2-(phenylmethyl)pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C24H22N4O2
MOLECULAR WEIGHT: 398.45708
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)COC3=CC=C(C=C3)NC4=CC=CC=C4
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-2-(2-bromo-4-fluoro-phenoxy)acetamide
CAS Name: 2-(2-bromo-4-fluorophenoxy)-N-[2-(phenylmethyl)-3-pyrazolyl]acetamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-2-(2-bromo-4-fluorophenoxy)acetamide
SYSTEMATIC NAME: 2-(2-bromanyl-4-fluoranyl-phenoxy)-N-[2-(phenylmethyl)pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C18H15BrFN3O2
MOLECULAR WEIGHT: 404.233003
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)COC3=C(C=C(C=C3)F)Br
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide
CAS Name: 3-[5-(diethylsulfamoyl)-1-methyl-2-benzimidazolyl]-N-[2-(phenylmethyl)-3-pyrazolyl]propanamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-3-[5-(diethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanamide
SYSTEMATIC NAME: 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide
MOLECULAR FORMULA: C25H30N6O3S
MOLECULAR WEIGHT: 494.6091
SMILES: CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=O)NC3=CC=NN3CC4=CC=CC=C4)C
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-3-(2-chlorophenyl)propanamide
CAS Name: 3-(2-chlorophenyl)-N-[2-(phenylmethyl)-3-pyrazolyl]propanamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-3-(2-chlorophenyl)propanamide
SYSTEMATIC NAME: 3-(2-chlorophenyl)-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide
MOLECULAR FORMULA: C19H18ClN3O
MOLECULAR WEIGHT: 339.81872
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCC3=CC=CC=C3Cl
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide
CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-[2-(phenylmethyl)-3-pyrazolyl]propanamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanamide
SYSTEMATIC NAME: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide
MOLECULAR FORMULA: C24H28N6O3S
MOLECULAR WEIGHT: 480.58252
SMILES: CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=NN3CC4=CC=CC=C4
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-2-(4-fluorophenyl)sulfanyl-acetamide
CAS Name: 2-[(4-fluorophenyl)thio]-N-[2-(phenylmethyl)-3-pyrazolyl]acetamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-2-(4-fluorophenyl)sulfanylacetamide
SYSTEMATIC NAME: 2-(4-fluorophenyl)sulfanyl-N-[2-(phenylmethyl)pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C18H16FN3OS
MOLECULAR WEIGHT: 341.402543
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CSC3=CC=C(C=C3)F
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Product OPENEYE NAME: N-(2-benzylpyrazol-3-yl)-2-(2-chlorophenyl)sulfanyl-acetamide
CAS Name: 2-[(2-chlorophenyl)thio]-N-[2-(phenylmethyl)-3-pyrazolyl]acetamide
IUPAC NAME: N-(2-benzylpyrazol-3-yl)-2-(2-chlorophenyl)sulfanylacetamide
SYSTEMATIC NAME: 2-(2-chlorophenyl)sulfanyl-N-[2-(phenylmethyl)pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C18H16ClN3OS
MOLECULAR WEIGHT: 357.85714
SMILES: C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CSC3=CC=CC=C3Cl
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