(phenylmethyl) N-[2-oxidanylidene-2-[1-oxidanyl-2-(2-phenylsulfanylethyl)pyrrolidin-2-yl]ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-oxidanylidene-2-[1-oxidanyl-2-(2-phenylsulfanylethyl)pyrrolidin-2-yl]ethyl]carbamate Openeye Name: benzyl N-[2-[1-hydroxy-2-(2-phenylsulfanylethyl)pyrrolidin-2-yl]-2-oxo-ethyl]carbamate CAS Name: N-[2-[1-hydroxy-2-[2-(phenylthio)ethyl]-2-pyrrolidinyl]-2-oxoethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[1-hydroxy-2-(2-phenylsulfanylethyl)pyrrolidin-2-yl]-2-oxoethyl]carbamate Traditional Name: N-[2-[1-hydroxy-2-[2-(phenylthio)ethyl]pyrrolidin-2-yl]-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)O)(CCSC2=CC=CC=C2)C(=O)CNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1)O)(CCSC2=CC=CC=C2)C(=O)CNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c25-20(16-23-21(26)28-17-18-8-3-1-4-9-18)22(12-7-14-24(22)27)13-15-29-19-10-5-2-6-11-19/h1-6,8-11,27H,7,12-17H2,(H,23,26)