(phenylmethyl) N-[1-[1-azanyl-2-[tert-butyl-(2-oxidanyl-4-phenyl-butyl)carbamoyl]piperidin-2-yl]-3-cyano-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[1-azanyl-2-[tert-butyl-(2-oxidanyl-4-phenyl-butyl)carbamoyl]piperidin-2-yl]-3-cyano-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[1-amino-2-[tert-butyl-(2-hydroxy-4-phenyl-butyl)carbamoyl]-2-piperidyl]-1-(cyanomethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-[1-amino-2-[[tert-butyl-(2-hydroxy-4-phenylbutyl)amino]-oxomethyl]-2-piperidinyl]-3-cyano-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[1-amino-2-[tert-butyl-(2-hydroxy-4-phenylbutyl)carbamoyl]piperidin-2-yl]-3-cyano-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[1-amino-2-[tert-butyl-(2-hydroxy-4-phenyl-butyl)carbamoyl]-2-piperidyl]-1-(cyanomethyl)-2-keto-ethyl]carbamic acid benzyl ester Formula: C32H43N5O5 MolecularWeight: 577.71432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC(CCC1=CC=CC=C1)O)C(=O)C2(CCCCN2N)C(=O)C(CC#N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N(CC(CCC1=CC=CC=C1)O)C(=O)C2(CCCCN2N)C(=O)C(CC#N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C32H43N5O5/c1-31(2,3)36(22-26(38)17-16-24-12-6-4-7-13-24)29(40)32(19-10-11-21-37(32)34)28(39)27(18-20-33)35-30(41)42-23-25-14-8-5-9-15-25/h4-9,12-15,26-27,38H,10-11,16-19,21-23,34H2,1-3H3,(H,35,41)