methyl (Z)-3-(2-methylphenyl)-3-(phenylmethylsulfanyl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(2-methylphenyl)-3-(phenylmethylsulfanyl)prop-2-enoate Openeye Name: methyl (Z)-3-benzylsulfanyl-3-(o-tolyl)prop-2-enoate CAS Name: (Z)-3-(2-methylphenyl)-3-(phenylmethylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-benzylsulfanyl-3-(2-methylphenyl)prop-2-enoate Traditional Name: (Z)-3-(benzylthio)-3-(o-tolyl)acrylic acid methyl ester Formula: C18H18O2S MolecularWeight: 298.39932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=CC(=O)OC)SCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1/C(=C/C(=O)OC)/SCC2=CC=CC=C2

InChI

InChI=1S/C18H18O2S/c1-14-8-6-7-11-16(14)17(12-18(19)20-2)21-13-15-9-4-3-5-10-15/h3-12H,13H2,1-2H3/b17-12-