4-ethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-ethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]benzenesulfonamide Openeye Name: 4-ethyl-N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 4-ethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]benzenesulfonamide IUPAC Name: 4-ethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]benzenesulfonamide Traditional Name: 4-ethyl-N-[2-(2-thienyl)-2-tosyl-ethyl]benzenesulfonamide Formula: C21H23NO4S3 MolecularWeight: 449.60662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H23NO4S3/c1-3-17-8-12-19(13-9-17)29(25,26)22-15-21(20-5-4-14-27-20)28(23,24)18-10-6-16(2)7-11-18/h4-14,21-22H,3,15H2,1-2H3