N-[4-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]benzenesulfonamide

Systemtic Name: N-[4-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]benzenesulfonamide Openeye Name: N-[4-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanylphenyl]benzenesulfonamide CAS Name: N-[4-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]phenyl]benzenesulfonamide IUPAC Name: N-[4-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanylphenyl]benzenesulfonamide Traditional Name: N-[4-[(2-keto-2-p-phenetyl-ethyl)thio]phenyl]benzenesulfonamide Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO4S2/c1-2-27-19-12-8-17(9-13-19)22(24)16-28-20-14-10-18(11-15-20)23-29(25,26)21-6-4-3-5-7-21/h3-15,23H,2,16H2,1H3