[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC(=O)NCCCC2=CC=CC=C2

InChI

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