Wednesday, May 15, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(4-iodophenyl)-2-(trifluoromethoxy)benzenesulfonamide
CAS Name: N-(4-iodophenyl)-2-(trifluoromethoxy)benzenesulfonamide
IUPAC NAME: N-(4-iodophenyl)-2-(trifluoromethoxy)benzenesulfonamide
SYSTEMATIC NAME: N-(4-iodophenyl)-2-(trifluoromethyloxy)benzenesulfonamide
MOLECULAR FORMULA: C13H9F3INO3S
MOLECULAR WEIGHT: 443.18014
SMILES: C1=CC=C(C(=C1)OC(F)(F)F)S(=O)(=O)NC2=CC=C(C=C2)I
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Product OPENEYE NAME: 1-(1-adamantylmethyl)-3-[(4-ureidophenyl)methyl]urea
CAS Name: 1-(1-adamantylmethyl)-3-[[4-(carbamoylamino)phenyl]methyl]urea
IUPAC NAME: 1-(1-adamantylmethyl)-3-[[4-(carbamoylamino)phenyl]methyl]urea
SYSTEMATIC NAME: 1-(1-adamantylmethyl)-3-[[4-(aminocarbonylamino)phenyl]methyl]urea
MOLECULAR FORMULA: C20H28N4O2
MOLECULAR WEIGHT: 356.46192
SMILES: C1C2CC3CC1CC(C2)(C3)CNC(=O)NCC4=CC=C(C=C4)NC(=O)N
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Product OPENEYE NAME: N-(2-phenylethyl)-3-pyrrol-1-yl-thiophene-2-carboxamide
CAS Name: N-(2-phenylethyl)-3-(1-pyrrolyl)-2-thiophenecarboxamide
IUPAC NAME: N-(2-phenylethyl)-3-pyrrol-1-ylthiophene-2-carboxamide
SYSTEMATIC NAME: N-(2-phenylethyl)-3-pyrrol-1-yl-thiophene-2-carboxamide
MOLECULAR FORMULA: C17H16N2OS
MOLECULAR WEIGHT: 296.38674
SMILES: C1=CC=C(C=C1)CCNC(=O)C2=C(C=CS2)N3C=CC=C3
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Product OPENEYE NAME: 5-methyl-N-(2-phenylethyl)-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide
CAS Name: 5-methyl-N-(2-phenylethyl)-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxamide
IUPAC NAME: 5-methyl-N-(2-phenylethyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide
SYSTEMATIC NAME: 5-methyl-N-(2-phenylethyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide
MOLECULAR FORMULA: C19H17F3N4O
MOLECULAR WEIGHT: 374.35969
SMILES: CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NCCC3=CC=CC=C3
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Product OPENEYE NAME: ethyl 5-(3-morpholinopropylsulfamoyl)-1H-pyrazole-4-carboxylate
CAS Name: 5-[3-(4-morpholinyl)propylsulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester
IUPAC NAME: ethyl 5-(3-morpholin-4-ylpropylsulfamoyl)-1H-pyrazole-4-carboxylate
SYSTEMATIC NAME: ethyl 5-(3-morpholin-4-ylpropylsulfamoyl)-1H-pyrazole-4-carboxylate
MOLECULAR FORMULA: C13H22N4O5S
MOLECULAR WEIGHT: 346.40258
SMILES: CCOC(=O)C1=C(NN=C1)S(=O)(=O)NCCCN2CCOCC2
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Product OPENEYE NAME: methyl 2-[3-(benzenesulfonyl)propanoyloxymethyl]furan-3-carboxylate
CAS Name: 2-[[3-(benzenesulfonyl)-1-oxopropoxy]methyl]-3-furancarboxylic acid methyl ester
IUPAC NAME: methyl 2-[3-(benzenesulfonyl)propanoyloxymethyl]furan-3-carboxylate
SYSTEMATIC NAME: methyl 2-[3-(phenylsulfonyl)propanoyloxymethyl]furan-3-carboxylate
MOLECULAR FORMULA: C16H16O7S
MOLECULAR WEIGHT: 352.35904
SMILES: COC(=O)C1=C(OC=C1)COC(=O)CCS(=O)(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 1-[(3-methyl-8-quinolyl)sulfonyl]-N-phenyl-piperidine-4-carboxamide
CAS Name: 1-[(3-methyl-8-quinolinyl)sulfonyl]-N-phenyl-4-piperidinecarboxamide
IUPAC NAME: 1-(3-methylquinolin-8-yl)sulfonyl-N-phenylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-(3-methylquinolin-8-yl)sulfonyl-N-phenyl-piperidine-4-carboxamide
MOLECULAR FORMULA: C22H23N3O3S
MOLECULAR WEIGHT: 409.50132
SMILES: CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4
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Product OPENEYE NAME: (2R,6R)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2R,6R)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6R)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6R)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H30N3O3S+
MOLECULAR WEIGHT: 368.5141
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: (2R,6R)-N-(1-benzyl-4-piperidyl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2R,6R)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6R)-N-(1-benzylpiperidin-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6R)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)NC2CCN(CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: (2R,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2R,6S)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H30N3O3S+
MOLECULAR WEIGHT: 368.5141
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: (2R,6S)-N-(1-benzyl-4-piperidyl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2R,6S)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-morpholinesulfonamide
IUPAC NAME: (2R,6S)-N-(1-benzylpiperidin-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2R,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)NC2CCN(CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: (2S,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-morpholinesulfonamide
IUPAC NAME: (2S,6S)-N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H30N3O3S+
MOLECULAR WEIGHT: 368.5141
SMILES: C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: (2S,6S)-N-(1-benzyl-4-piperidyl)-2,6-dimethyl-morpholine-4-sulfonamide
CAS Name: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-morpholinesulfonamide
IUPAC NAME: (2S,6S)-N-(1-benzylpiperidin-4-yl)-2,6-dimethylmorpholine-4-sulfonamide
SYSTEMATIC NAME: (2S,6S)-2,6-dimethyl-N-[1-(phenylmethyl)piperidin-4-yl]morpholine-4-sulfonamide
MOLECULAR FORMULA: C18H29N3O3S
MOLECULAR WEIGHT: 367.50616
SMILES: C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)NC2CCN(CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(4-ureidophenyl)methyl]urea
CAS Name: 1-[[4-(carbamoylamino)phenyl]methyl]-3-[2-[(4-chlorophenyl)thio]ethyl]urea
IUPAC NAME: 1-[[4-(carbamoylamino)phenyl]methyl]-3-[2-(4-chlorophenyl)sulfanylethyl]urea
SYSTEMATIC NAME: 1-[[4-(aminocarbonylamino)phenyl]methyl]-3-[2-(4-chlorophenyl)sulfanylethyl]urea
MOLECULAR FORMULA: C17H19ClN4O2S
MOLECULAR WEIGHT: 378.87636
SMILES: C1=CC(=CC=C1CNC(=O)NCCSC2=CC=C(C=C2)Cl)NC(=O)N
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Product OPENEYE NAME: 1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
CAS Name: 1-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
MOLECULAR FORMULA: C12H23N3O4S
MOLECULAR WEIGHT: 305.39372
SMILES: C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N2CCC(CC2)C(=O)N
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Product OPENEYE NAME: 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
CAS Name: 1-[[(2S,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
MOLECULAR FORMULA: C12H23N3O4S
MOLECULAR WEIGHT: 305.39372
SMILES: C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCC(CC2)C(=O)N
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Product OPENEYE NAME: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
CAS Name: 1-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-4-carboxamide
MOLECULAR FORMULA: C12H23N3O4S
MOLECULAR WEIGHT: 305.39372
SMILES: C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)N2CCC(CC2)C(=O)N
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