S-(4-methylphenyl) 2-acetamido-3-methyl-butanethioate

Systemtic Name: S-(4-methylphenyl) 2-acetamido-3-methyl-butanethioate Openeye Name: S-(p-tolyl) 2-acetamido-3-methyl-butanethioate CAS Name: 2-acetamido-3-methylbutanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-acetamido-3-methylbutanethioate Traditional Name: 2-acetamido-3-methyl-butanethioic acid S-(p-tolyl) ester Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO2S/c1-9(2)13(15-11(4)16)14(17)18-12-7-5-10(3)6-8-12/h5-9,13H,1-4H3,(H,15,16)