[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C20H21NO3S/c1-14-7-5-6-10-17(14)25-13-18(22)24-19(15-8-3-2-4-9-15)20(23)21-16-11-12-16/h2-10,16,19H,11-13H2,1H3,(H,21,23)