(phenylmethyl) N-[4-methyl-1-oxidanylidene-1-[[2-oxidanylidene-3-(pyridin-3-ylmethylsulfanyl)propyl]amino]pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-methyl-1-oxidanylidene-1-[[2-oxidanylidene-3-(pyridin-3-ylmethylsulfanyl)propyl]amino]pentan-2-yl]carbamate Openeye Name: benzyl N-[3-methyl-1-[[2-oxo-3-(3-pyridylmethylsulfanyl)propyl]carbamoyl]butyl]carbamate CAS Name: N-[4-methyl-1-oxo-1-[[2-oxo-3-(3-pyridinylmethylthio)propyl]amino]pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-methyl-1-oxo-1-[[2-oxo-3-(pyridin-3-ylmethylsulfanyl)propyl]amino]pentan-2-yl]carbamate Traditional Name: N-[1-[[2-keto-3-(3-pyridylmethylthio)propyl]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)CSCC1=CN=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NCC(=O)CSCC1=CN=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O4S/c1-17(2)11-21(26-23(29)30-14-18-7-4-3-5-8-18)22(28)25-13-20(27)16-31-15-19-9-6-10-24-12-19/h3-10,12,17,21H,11,13-16H2,1-2H3,(H,25,28)(H,26,29)