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

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-propyl-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-4-propyl-benzenesulfonamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-4-propylbenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-4-propylbenzenesulfonamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-4-propyl-benzenesulfonamide Formula: C21H22ClNO4S3 MolecularWeight: 484.05168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO4S3/c1-2-4-16-6-10-19(11-7-16)30(26,27)23-15-21(20-5-3-14-28-20)29(24,25)18-12-8-17(22)9-13-18/h3,5-14,21,23H,2,4,15H2,1H3