(E)-2-cyano-3-(4-methylphenyl)-N-[2-(phenylmethylsulfanyl)ethyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-methylphenyl)-N-[2-(phenylmethylsulfanyl)ethyl]prop-2-enamide Openeye Name: (E)-N-(2-benzylsulfanylethyl)-2-cyano-3-(p-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-methylphenyl)-N-[2-(phenylmethylthio)ethyl]-2-propenamide IUPAC Name: (E)-N-(2-benzylsulfanylethyl)-2-cyano-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(benzylthio)ethyl]-2-cyano-3-(p-tolyl)acrylamide Formula: C20H20N2OS MolecularWeight: 336.4506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C20H20N2OS/c1-16-7-9-17(10-8-16)13-19(14-21)20(23)22-11-12-24-15-18-5-3-2-4-6-18/h2-10,13H,11-12,15H2,1H3,(H,22,23)/b19-13+