[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-methylpropanoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-methylpropanoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC(=O)NC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)C(=O)OCC(=O)NC1=CC(=CC=C1)SC

InChI

InChI=1S/C13H17NO3S/c1-9(2)13(16)17-8-12(15)14-10-5-4-6-11(7-10)18-3/h4-7,9H,8H2,1-3H3,(H,14,15)