N-[2-(4-methylphenyl)sulfanylethyl]-4-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(methylsulfonylmethyl)benzamide Openeye Name: 4-(methylsulfonylmethyl)-N-[2-(p-tolylsulfanyl)ethyl]benzamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-(methylsulfonylmethyl)benzamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(methylsulfonylmethyl)benzamide Traditional Name: 4-(mesylmethyl)-N-[2-(p-tolylthio)ethyl]benzamide Formula: C18H21NO3S2 MolecularWeight: 363.49424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CS(=O)(=O)C

InChI

InChI=1S/C18H21NO3S2/c1-14-3-9-17(10-4-14)23-12-11-19-18(20)16-7-5-15(6-8-16)13-24(2,21)22/h3-10H,11-13H2,1-2H3,(H,19,20)