N-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[[2-[[2-(hydroxymethyl)phenyl]thio]phenyl]methyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: 2,5-dimethoxy-N-[2-[(2-methylolphenyl)thio]benzyl]benzenesulfonamide Formula: C22H23NO5S2 MolecularWeight: 445.55172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NCC2=CC=CC=C2SC3=CC=CC=C3CO

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NCC2=CC=CC=C2SC3=CC=CC=C3CO

InChI

InChI=1S/C22H23NO5S2/c1-27-18-11-12-19(28-2)22(13-18)30(25,26)23-14-16-7-3-5-9-20(16)29-21-10-6-4-8-17(21)15-24/h3-13,23-24H,14-15H2,1-2H3