[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-(4-methanoylphenoxy)ethanoate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-(4-methanoylphenoxy)ethanoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] 2-(4-formylphenoxy)acetate CAS Name: 2-(4-formylphenoxy)acetic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] 2-(4-formylphenoxy)acetate Traditional Name: 2-(4-formylphenoxy)acetic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)COC2=CC=C(C=C2)C=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)COC2=CC=C(C=C2)C=O

InChI

InChI=1S/C20H21NO5S/c1-15-2-8-18(9-3-15)27-11-10-21-19(23)13-26-20(24)14-25-17-6-4-16(12-22)5-7-17/h2-9,12H,10-11,13-14H2,1H3,(H,21,23)