3,4-dimethoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[4-[(phenylthio)methyl]phenyl]benzenesulfonamide Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)OC

InChI

InChI=1S/C21H21NO4S2/c1-25-20-13-12-19(14-21(20)26-2)28(23,24)22-17-10-8-16(9-11-17)15-27-18-6-4-3-5-7-18/h3-14,22H,15H2,1-2H3