2-[[4-azanylbutyl-(phenylmethyl)amino]-(4-methylpentanoyl)amino]-N-(oxan-2-yloxy)-5-phenyl-pentanamide

Systemtic Name: 2-[[4-azanylbutyl-(phenylmethyl)amino]-(4-methylpentanoyl)amino]-N-(oxan-2-yloxy)-5-phenyl-pentanamide Openeye Name: 2-[[4-aminobutyl(benzyl)amino]-(4-methylpentanoyl)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pentanamide CAS Name: 2-[[4-aminobutyl-(phenylmethyl)amino]-(4-methyl-1-oxopentyl)amino]-N-(2-oxanyloxy)-5-phenylpentanamide IUPAC Name: 2-[[4-aminobutyl(benzyl)amino]-(4-methylpentanoyl)amino]-N-(oxan-2-yloxy)-5-phenylpentanamide Traditional Name: 2-[[4-aminobutyl(benzyl)amino]-(4-methylpentanoyl)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-valeramide Formula: C33H50N4O4 MolecularWeight: 566.7745

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CCCC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CCCCN)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCC(=O)N(C(CCCC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CCCCN)CC3=CC=CC=C3

InChI

InChI=1S/C33H50N4O4/c1-27(2)21-22-31(38)37(36(24-11-10-23-34)26-29-16-7-4-8-17-29)30(19-13-18-28-14-5-3-6-15-28)33(39)35-41-32-20-9-12-25-40-32/h3-8,14-17,27,30,32H,9-13,18-26,34H2,1-2H3,(H,35,39)