[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 2-(2-oxo-1-pyrrolidinyl)benzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 2-(2-ketopyrrolidino)benzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4S/c25-20(23-13-7-15-29-17-8-2-1-3-9-17)16-28-22(27)18-10-4-5-11-19(18)24-14-6-12-21(24)26/h1-5,8-11H,6-7,12-16H2,(H,23,25)