[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3-phenylpropanoate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3-phenylpropanoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO3S/c1-16-7-10-18(11-8-16)25-14-13-21-19(22)15-24-20(23)12-9-17-5-3-2-4-6-17/h2-8,10-11H,9,12-15H2,1H3,(H,21,22)