3,4-dimethyl-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[2-(phenylmethylsulfanyl)ethyl]benzenesulfonamide Openeye Name: N-(2-benzylsulfanylethyl)-3,4-dimethyl-benzenesulfonamide CAS Name: 3,4-dimethyl-N-[2-(phenylmethylthio)ethyl]benzenesulfonamide IUPAC Name: N-(2-benzylsulfanylethyl)-3,4-dimethylbenzenesulfonamide Traditional Name: N-[2-(benzylthio)ethyl]-3,4-dimethyl-benzenesulfonamide Formula: C17H21NO2S2 MolecularWeight: 335.48414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCSCC2=CC=CC=C2)C

InChI

InChI=1S/C17H21NO2S2/c1-14-8-9-17(12-15(14)2)22(19,20)18-10-11-21-13-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13H2,1-2H3