[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(4-ethoxyphenyl)sulfanylethanoate

Systemtic Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(4-ethoxyphenyl)sulfanylethanoate Openeye Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl] 2-(4-ethoxyphenyl)sulfanylacetate CAS Name: 2-[(4-ethoxyphenyl)thio]acetic acid [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl] 2-(4-ethoxyphenyl)sulfanylacetate Traditional Name: 2-(p-phenetylthio)acetic acid [2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SCC(=O)OCC(=O)NCCC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)SCC(=O)OCC(=O)NCCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H22ClNO4S/c1-2-25-17-6-8-18(9-7-17)27-14-20(24)26-13-19(23)22-11-10-15-4-3-5-16(21)12-15/h3-9,12H,2,10-11,13-14H2,1H3,(H,22,23)