N-(5-azanyl-4-oxidanyl-2-oxidanylidene-pentyl)-4-methyl-2-[[2-[2-(2-methylprop-2-enoylamino)ethanoylamino]-3-phenyl-propanoyl]amino]pentanamide

Systemtic Name: N-(5-azanyl-4-oxidanyl-2-oxidanylidene-pentyl)-4-methyl-2-[[2-[2-(2-methylprop-2-enoylamino)ethanoylamino]-3-phenyl-propanoyl]amino]pentanamide Openeye Name: N-(5-amino-4-hydroxy-2-oxo-pentyl)-4-methyl-2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]-3-phenyl-propanoyl]amino]pentanamide CAS Name: N-(5-amino-4-hydroxy-2-oxopentyl)-4-methyl-2-[[2-[[2-[(2-methyl-1-oxoprop-2-enyl)amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]pentanamide IUPAC Name: N-(5-amino-4-hydroxy-2-oxopentyl)-4-methyl-2-[[2-[[2-(2-methylprop-2-enoylamino)acetyl]amino]-3-phenylpropanoyl]amino]pentanamide Traditional Name: N-(5-amino-4-hydroxy-2-keto-pentyl)-2-[[2-[(2-methacrylamidoacetyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-valeramide Formula: C26H39N5O6 MolecularWeight: 517.61776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)CC(CN)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(=C)C

Isomeric SMILES

CC(C)CC(C(=O)NCC(=O)CC(CN)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(=C)C

InChI

InChI=1S/C26H39N5O6/c1-16(2)10-21(25(36)28-14-20(33)12-19(32)13-27)31-26(37)22(11-18-8-6-5-7-9-18)30-23(34)15-29-24(35)17(3)4/h5-9,16,19,21-22,32H,3,10-15,27H2,1-2,4H3,(H,28,36)(H,29,35)(H,30,34)(H,31,37)