2-azanyl-N-[1-[(4-azanyl-5-cyclohexyl-3-oxidanyl-pentanoyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-pentanamide

Systemtic Name: 2-azanyl-N-[1-[(4-azanyl-5-cyclohexyl-3-oxidanyl-pentanoyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-pentanamide Openeye Name: 2-amino-N-[2-[(4-amino-5-cyclohexyl-3-hydroxy-pentanoyl)amino]-1-benzyl-2-oxo-ethyl]-4-methyl-pentanamide CAS Name: 2-amino-N-[1-[(4-amino-5-cyclohexyl-3-hydroxy-1-oxopentyl)amino]-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide IUPAC Name: 2-amino-N-[1-[(4-amino-5-cyclohexyl-3-hydroxypentanoyl)amino]-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide Traditional Name: 2-amino-N-[2-[(4-amino-5-cyclohexyl-3-hydroxy-pentanoyl)amino]-1-benzyl-2-keto-ethyl]-4-methyl-valeramide Formula: C26H42N4O4 MolecularWeight: 474.63608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(=O)CC(C(CC2CCCCC2)N)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(=O)CC(C(CC2CCCCC2)N)O)N

InChI

InChI=1S/C26H42N4O4/c1-17(2)13-21(28)25(33)29-22(15-19-11-7-4-8-12-19)26(34)30-24(32)16-23(31)20(27)14-18-9-5-3-6-10-18/h4,7-8,11-12,17-18,20-23,31H,3,5-6,9-10,13-16,27-28H2,1-2H3,(H,29,33)(H,30,32,34)