[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-(4-methoxyphenoxy)propanoate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-(4-methoxyphenoxy)propanoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] 2-(4-methoxyphenoxy)propanoate CAS Name: 2-(4-methoxyphenoxy)propanoic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] 2-(4-methoxyphenoxy)propanoate Traditional Name: 2-(4-methoxyphenoxy)propionic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C(C)OC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C(C)OC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25NO5S/c1-15-4-10-19(11-5-15)28-13-12-22-20(23)14-26-21(24)16(2)27-18-8-6-17(25-3)7-9-18/h4-11,16H,12-14H2,1-3H3,(H,22,23)