[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 2-(2-oxo-1-pyrrolidinyl)benzoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 2-(2-ketopyrrolidino)benzoic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c24-19(22-12-14-28-16-7-2-1-3-8-16)15-27-21(26)17-9-4-5-10-18(17)23-13-6-11-20(23)25/h1-5,7-10H,6,11-15H2,(H,22,24)