[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-oxo-2-[4-(2-oxo-1-pyrrolidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-keto-2-[4-(2-ketopyrrolidino)anilino]ethyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H22N2O4S/c1-15-5-2-3-6-18(15)28-14-21(26)27-13-19(24)22-16-8-10-17(11-9-16)23-12-4-7-20(23)25/h2-3,5-6,8-11H,4,7,12-14H2,1H3,(H,22,24)