S-(4-methylphenyl) 2-acetamido-4-phenyl-butanethioate

Systemtic Name: S-(4-methylphenyl) 2-acetamido-4-phenyl-butanethioate Openeye Name: S-(p-tolyl) 2-acetamido-4-phenyl-butanethioate CAS Name: 2-acetamido-4-phenylbutanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-acetamido-4-phenylbutanethioate Traditional Name: 2-acetamido-4-phenyl-butanethioic acid S-(p-tolyl) ester Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C(CCC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C(CCC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C19H21NO2S/c1-14-8-11-17(12-9-14)23-19(22)18(20-15(2)21)13-10-16-6-4-3-5-7-16/h3-9,11-12,18H,10,13H2,1-2H3,(H,20,21)