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

Systemtic Name: 1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: 1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C21H20N4O4S3 MolecularWeight: 488.6029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=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)N2C=C(C(=N2)C3=CC=CS3)S(=O)(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H20N4O4S3/c22-31(26,27)18-10-8-16(9-11-18)12-13-23-32(28,29)20-15-25(17-5-2-1-3-6-17)24-21(20)19-7-4-14-30-19/h1-11,14-15,23H,12-13H2,(H2,22,26,27)