[4-(4-methylphenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl] butanoate

Systemtic Name: [4-(4-methylphenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl] butanoate Openeye Name: [4-(p-tolyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl] butanoate CAS Name: butanoic acid [4-(4-methylphenyl)-3-(4-sulfamoylphenyl)-1-pyrazolyl] ester IUPAC Name: [4-(4-methylphenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl] butanoate Traditional Name: butyric acid [4-(p-tolyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl] ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)ON1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC(=O)ON1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N3O4S/c1-3-4-19(24)27-23-13-18(15-7-5-14(2)6-8-15)20(22-23)16-9-11-17(12-10-16)28(21,25)26/h5-13H,3-4H2,1-2H3,(H2,21,25,26)