(phenylmethyl) N-[4-azanyl-5-cyclohexyl-3-(1H-imidazol-2-yl)-3-oxidanyl-2-oxidanylidene-1-propan-2-ylsulfanyl-pentyl]-N-(2-azanyl-3-phenyl-propanoyl)carbamate

Systemtic Name: (phenylmethyl) N-[4-azanyl-5-cyclohexyl-3-(1H-imidazol-2-yl)-3-oxidanyl-2-oxidanylidene-1-propan-2-ylsulfanyl-pentyl]-N-(2-azanyl-3-phenyl-propanoyl)carbamate Openeye Name: benzyl N-[4-amino-5-cyclohexyl-3-hydroxy-3-(1H-imidazol-2-yl)-1-isopropylsulfanyl-2-oxo-pentyl]-N-(2-amino-3-phenyl-propanoyl)carbamate CAS Name: N-[4-amino-5-cyclohexyl-3-hydroxy-3-(1H-imidazol-2-yl)-2-oxo-1-(propan-2-ylthio)pentyl]-N-(2-amino-1-oxo-3-phenylpropyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-amino-5-cyclohexyl-3-hydroxy-3-(1H-imidazol-2-yl)-2-oxo-1-propan-2-ylsulfanylpentyl]-N-(2-amino-3-phenylpropanoyl)carbamate Traditional Name: N-[4-amino-5-cyclohexyl-3-hydroxy-3-(1H-imidazol-2-yl)-1-(isopropylthio)-2-keto-pentyl]-N-phenylalanyl-carbamic acid benzyl ester Formula: C34H45N5O5S MolecularWeight: 635.8166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C(=O)C(C1=NC=CN1)(C(CC2CCCCC2)N)O)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)SC(C(=O)C(C1=NC=CN1)(C(CC2CCCCC2)N)O)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C34H45N5O5S/c1-23(2)45-31(29(40)34(43,32-37-18-19-38-32)28(36)21-25-14-8-4-9-15-25)39(33(42)44-22-26-16-10-5-11-17-26)30(41)27(35)20-24-12-6-3-7-13-24/h3,5-7,10-13,16-19,23,25,27-28,31,43H,4,8-9,14-15,20-22,35-36H2,1-2H3,(H,37,38)