1-(phenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: 1-(phenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: 1-(phenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C22H22N4O4S3 MolecularWeight: 502.62948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H22N4O4S3/c23-32(27,28)19-10-8-17(9-11-19)12-13-24-33(29,30)21-16-26(15-18-5-2-1-3-6-18)25-22(21)20-7-4-14-31-20/h1-11,14,16,24H,12-13,15H2,(H2,23,27,28)