[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 4-(dimethylsulfamoyl)benzoate

Systemtic Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 4-(dimethylsulfamoyl)benzoate Openeye Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid [3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl ester Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H22ClN3O4S/c1-28(2)34(31,32)23-14-10-19(11-15-23)25(30)33-17-20-16-29(22-6-4-3-5-7-22)27-24(20)18-8-12-21(26)13-9-18/h3-16H,17H2,1-2H3