Sunday, March 31, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(methylcarbamoyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)ethanamide
MOLECULAR FORMULA: C14H20ClN4O4S+
MOLECULAR WEIGHT: 375.851
SMILES: CNC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(methylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(methylcarbamoyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(methylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(methylcarbamoyl)ethanamide
MOLECULAR FORMULA: C14H19ClN4O4S
MOLECULAR WEIGHT: 374.84306
SMILES: CNC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: ethyl 3-[(3,4-dimethylphenyl)carbamoyl]-5-nitro-benzoate
CAS Name: 3-[(3,4-dimethylanilino)-oxomethyl]-5-nitrobenzoic acid ethyl ester
IUPAC NAME: ethyl 3-[(3,4-dimethylphenyl)carbamoyl]-5-nitrobenzoate
SYSTEMATIC NAME: ethyl 3-[(3,4-dimethylphenyl)carbamoyl]-5-nitro-benzoate
MOLECULAR FORMULA: C18H18N2O5
MOLECULAR WEIGHT: 342.34592
SMILES: CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)C)C)[N+](=O)[O-]
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 4-(1,3-dioxoisoindolin-2-yl)butanoate
CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 4-(1,3-dioxoisoindol-2-yl)butanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate
MOLECULAR FORMULA: C17H16N2O7
MOLECULAR WEIGHT: 360.31814
SMILES: C1COC(=O)N1C(=O)COC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O
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Product OPENEYE NAME: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester
IUPAC NAME: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H14O6
MOLECULAR WEIGHT: 338.31086
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)C3=CC4=C(C=C3)OCO4
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Product OPENEYE NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-furan-3-carboxylate
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-methyl-3-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methylfuran-3-carboxylate
SYSTEMATIC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-furan-3-carboxylate
MOLECULAR FORMULA: C18H22ClN2O5S+
MOLECULAR WEIGHT: 413.89568
SMILES: CC1=C(C=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)OC
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Product OPENEYE NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-methyl-furan-3-carboxylate
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-2-methyl-3-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-methylfuran-3-carboxylate
SYSTEMATIC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-methyl-furan-3-carboxylate
MOLECULAR FORMULA: C18H21ClN2O5S
MOLECULAR WEIGHT: 412.88774
SMILES: CC1=C(C=C(O1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)OC
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Product OPENEYE NAME: (E)-N-(3,4-dimethylphenyl)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]prop-2-enamide
CAS Name: (E)-N-(3,4-dimethylphenyl)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2-propenamide
IUPAC NAME: (E)-N-(3,4-dimethylphenyl)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]prop-2-enamide
SYSTEMATIC NAME: (E)-N-(3,4-dimethylphenyl)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]prop-2-enamide
MOLECULAR FORMULA: C20H24N2O4S
MOLECULAR WEIGHT: 388.48056
SMILES: CC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)OC)S(=O)(=O)N(C)C)C
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Product OPENEYE NAME: [2-(3-thienyl)thiazol-4-yl]methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate
CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester
IUPAC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate
SYSTEMATIC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate
MOLECULAR FORMULA: C20H16N2O4S2
MOLECULAR WEIGHT: 412.48204
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC3=CSC(=N3)C4=CSC=C4
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Product OPENEYE NAME: [2-oxo-2-(4-propoxycarbonylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-oxo-2-[4-[oxo(propoxy)methyl]anilino]ethyl] ester
IUPAC NAME: [2-oxo-2-(4-propoxycarbonylanilino)ethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(4-propoxycarbonylphenyl)amino]ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C22H21NO6
MOLECULAR WEIGHT: 395.40524
SMILES: CCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]carbamate
MOLECULAR FORMULA: C15H21ClN3O5S+
MOLECULAR WEIGHT: 390.86234
SMILES: CCOC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethanoyl]carbamate
MOLECULAR FORMULA: C15H20ClN3O5S
MOLECULAR WEIGHT: 389.8544
SMILES: CCOC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-2-(2-naphthyl)acetamide
CAS Name: N-(3,4-dimethylphenyl)-2-(2-naphthalenyl)acetamide
IUPAC NAME: N-(3,4-dimethylphenyl)-2-naphthalen-2-ylacetamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-2-naphthalen-2-yl-ethanamide
MOLECULAR FORMULA: C20H19NO
MOLECULAR WEIGHT: 289.37096
SMILES: CC1=C(C=C(C=C1)NC(=O)CC2=CC3=CC=CC=C3C=C2)C
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Product OPENEYE NAME: [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester
IUPAC NAME: [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C19H13F2NO6
MOLECULAR WEIGHT: 389.306426
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-methoxyphenoxy)acetamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-(4-methoxyphenoxy)acetamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-methoxyphenoxy)acetamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-methoxyphenoxy)ethanamide
MOLECULAR FORMULA: C18H20FNO3S
MOLECULAR WEIGHT: 349.419703
SMILES: COC1=CC=C(C=C1)OCC(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: [5-(2-thienyl)isoxazol-3-yl]methyl 2-[(3-methylbenzoyl)amino]acetate
CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester
IUPAC NAME: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-[(3-methylbenzoyl)amino]acetate
SYSTEMATIC NAME: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-[(3-methylphenyl)carbonylamino]ethanoate
MOLECULAR FORMULA: C18H16N2O4S
MOLECULAR WEIGHT: 356.39564
SMILES: CC1=CC=CC(=C1)C(=O)NCC(=O)OCC2=NOC(=C2)C3=CC=CS3
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-1-isopropyl-2,5-dimethyl-pyrrole-3-carboxamide
CAS Name: N-(3,4-dimethylphenyl)-2,5-dimethyl-1-propan-2-yl-3-pyrrolecarboxamide
IUPAC NAME: N-(3,4-dimethylphenyl)-2,5-dimethyl-1-propan-2-ylpyrrole-3-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-2,5-dimethyl-1-propan-2-yl-pyrrole-3-carboxamide
MOLECULAR FORMULA: C18H24N2O
MOLECULAR WEIGHT: 284.39596
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=C(N(C(=C2)C)C(C)C)C)C
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Product OPENEYE NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
SYSTEMATIC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
MOLECULAR FORMULA: C17H20ClN2O5S+
MOLECULAR WEIGHT: 399.8691
SMILES: COC(=O)C1=CC=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-2-carboxylate
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-2-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-2-carboxylate
SYSTEMATIC NAME: methyl 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-2-carboxylate
MOLECULAR FORMULA: C17H19ClN2O5S
MOLECULAR WEIGHT: 398.86116
SMILES: COC(=O)C1=CC=C(O1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(ethylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(ethylcarbamoyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(ethylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(ethylcarbamoyl)ethanamide
MOLECULAR FORMULA: C15H22ClN4O4S+
MOLECULAR WEIGHT: 389.87758
SMILES: CCNC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(ethylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(ethylcarbamoyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(ethylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(ethylcarbamoyl)ethanamide
MOLECULAR FORMULA: C15H21ClN4O4S
MOLECULAR WEIGHT: 388.86964
SMILES: CCNC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-5-methyl-2-phenyl-triazole-4-carboxamide
CAS Name: N-(3,4-dimethylphenyl)-5-methyl-2-phenyl-4-triazolecarboxamide
IUPAC NAME: N-(3,4-dimethylphenyl)-5-methyl-2-phenyltriazole-4-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide
MOLECULAR FORMULA: C18H18N4O
MOLECULAR WEIGHT: 306.36172
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=NN(N=C2C)C3=CC=CC=C3)C
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Product OPENEYE NAME: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester
IUPAC NAME: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2H-chromene-3-carboxylate
SYSTEMATIC NAME: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C22H18O5
MOLECULAR WEIGHT: 362.37532
SMILES: CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=CC=CC=C4OC3)C
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