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

Systemtic Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-4-methyl-benzenesulfonamide Formula: C20H21NO5S3 MolecularWeight: 451.57944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21NO5S3/c1-15-5-9-18(10-6-15)29(24,25)21-14-20(19-4-3-13-27-19)28(22,23)17-11-7-16(26-2)8-12-17/h3-13,20-21H,14H2,1-2H3