3,4-dimethoxy-N-[1-(4-methylsulfanylphenyl)-1,3-bis(oxidanyl)propan-2-yl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[1-(4-methylsulfanylphenyl)-1,3-bis(oxidanyl)propan-2-yl]benzenesulfonamide Openeye Name: N-[2-hydroxy-1-(hydroxymethyl)-2-(4-methylsulfanylphenyl)ethyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[1,3-dihydroxy-1-[4-(methylthio)phenyl]propan-2-yl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[1,3-dihydroxy-1-(4-methylsulfanylphenyl)propan-2-yl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[2-hydroxy-1-methylol-2-[4-(methylthio)phenyl]ethyl]-3,4-dimethoxy-benzenesulfonamide Formula: C18H23NO6S2 MolecularWeight: 413.50832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC(CO)C(C2=CC=C(C=C2)SC)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC(CO)C(C2=CC=C(C=C2)SC)O)OC

InChI

InChI=1S/C18H23NO6S2/c1-24-16-9-8-14(10-17(16)25-2)27(22,23)19-15(11-20)18(21)12-4-6-13(26-3)7-5-12/h4-10,15,18-21H,11H2,1-3H3