methyl 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate

Systemtic Name: methyl 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid methyl ester Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NN1CCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=C(C(=NN1CCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3O4S/c1-33-25(30)24-22(18-7-11-20(26)12-8-18)23(19-9-13-21(14-10-19)34(27,31)32)28-29(24)16-15-17-5-3-2-4-6-17/h2-14H,15-16H2,1H3,(H2,27,31,32)