N-[4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]benzenesulfonamide

Systemtic Name: N-[4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]benzenesulfonamide Openeye Name: N-[4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanylphenyl]benzenesulfonamide CAS Name: N-[4-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]phenyl]benzenesulfonamide IUPAC Name: N-[4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanylphenyl]benzenesulfonamide Traditional Name: N-[4-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]phenyl]benzenesulfonamide Formula: C22H21NO5S2 MolecularWeight: 443.53584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H21NO5S2/c1-27-21-13-8-16(14-22(21)28-2)20(24)15-29-18-11-9-17(10-12-18)23-30(25,26)19-6-4-3-5-7-19/h3-14,23H,15H2,1-2H3