(phenylmethyl) N-[2-oxidanylidene-1-propan-2-ylsulfanyl-2-(2-pyridin-2-ylpyrrolidin-1-yl)ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-oxidanylidene-1-propan-2-ylsulfanyl-2-(2-pyridin-2-ylpyrrolidin-1-yl)ethyl]carbamate Openeye Name: benzyl N-[1-isopropylsulfanyl-2-oxo-2-[2-(2-pyridyl)pyrrolidin-1-yl]ethyl]carbamate CAS Name: N-[2-oxo-1-(propan-2-ylthio)-2-[2-(2-pyridinyl)-1-pyrrolidinyl]ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-oxo-1-propan-2-ylsulfanyl-2-(2-pyridin-2-ylpyrrolidin-1-yl)ethyl]carbamate Traditional Name: N-[1-(isopropylthio)-2-keto-2-[2-(2-pyridyl)pyrrolidino]ethyl]carbamic acid benzyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C(=O)N1CCCC1C2=CC=CC=N2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)SC(C(=O)N1CCCC1C2=CC=CC=N2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-16(2)29-20(24-22(27)28-15-17-9-4-3-5-10-17)21(26)25-14-8-12-19(25)18-11-6-7-13-23-18/h3-7,9-11,13,16,19-20H,8,12,14-15H2,1-2H3,(H,24,27)