N-[4-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[2-(3-methoxyphenyl)-2-oxo-ethyl]sulfanylphenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[[2-(3-methoxyphenyl)-2-oxoethyl]thio]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[2-(3-methoxyphenyl)-2-oxoethyl]sulfanylphenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[[2-keto-2-(3-methoxyphenyl)ethyl]thio]phenyl]-4-methyl-benzenesulfonamide Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC(=CC=C3)OC

InChI

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