(phenylmethyl) N-(4-azanyl-5-cyclohexyl-3-oxidanyl-2-oxidanylidene-1-propan-2-yloxy-3-pyridin-2-yl-pentyl)-N-(2-azanyl-3-phenyl-propanoyl)carbamate

Systemtic Name: (phenylmethyl) N-(4-azanyl-5-cyclohexyl-3-oxidanyl-2-oxidanylidene-1-propan-2-yloxy-3-pyridin-2-yl-pentyl)-N-(2-azanyl-3-phenyl-propanoyl)carbamate Openeye Name: benzyl N-[4-amino-5-cyclohexyl-3-hydroxy-1-isopropoxy-2-oxo-3-(2-pyridyl)pentyl]-N-(2-amino-3-phenyl-propanoyl)carbamate CAS Name: N-[4-amino-5-cyclohexyl-3-hydroxy-2-oxo-1-propan-2-yloxy-3-(2-pyridinyl)pentyl]-N-(2-amino-1-oxo-3-phenylpropyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-amino-5-cyclohexyl-3-hydroxy-2-oxo-1-propan-2-yloxy-3-pyridin-2-ylpentyl)-N-(2-amino-3-phenylpropanoyl)carbamate Traditional Name: N-[4-amino-5-cyclohexyl-3-hydroxy-1-isopropoxy-2-keto-3-(2-pyridyl)pentyl]-N-phenylalanyl-carbamic acid benzyl ester Formula: C36H46N4O6 MolecularWeight: 630.77364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C(=O)C(C1=CC=CC=N1)(C(CC2CCCCC2)N)O)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(C(=O)C(C1=CC=CC=N1)(C(CC2CCCCC2)N)O)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C36H46N4O6/c1-25(2)46-34(32(41)36(44,31-20-12-13-21-39-31)30(38)23-27-16-8-4-9-17-27)40(35(43)45-24-28-18-10-5-11-19-28)33(42)29(37)22-26-14-6-3-7-15-26/h3,5-7,10-15,18-21,25,27,29-30,34,44H,4,8-9,16-17,22-24,37-38H2,1-2H3