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

Systemtic Name: methyl 4-(4-methylphenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Openeye Name: methyl 2-phenethyl-4-(p-tolyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-phenethyl-5-(4-sulfamoylphenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-phenethyl-5-(4-sulfamoylphenyl)pyrazole-3-carboxylate Traditional Name: 2-phenethyl-4-(p-tolyl)-5-(4-sulfamoylphenyl)pyrazole-3-carboxylic acid methyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H25N3O4S/c1-18-8-10-20(11-9-18)23-24(21-12-14-22(15-13-21)34(27,31)32)28-29(25(23)26(30)33-2)17-16-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H2,27,31,32)