N-[5-(1-adamantyl)-1,2-oxazol-3-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanamide

Systemtic Name: N-[5-(1-adamantyl)-1,2-oxazol-3-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanamide Openeye Name: N-[5-(1-adamantyl)isoxazol-3-yl]-2-[(2-hydroxy-2-phenyl-acetyl)amino]pentanamide CAS Name: N-[5-(1-adamantyl)-3-isoxazolyl]-2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]pentanamide IUPAC Name: N-[5-(1-adamantyl)-1,2-oxazol-3-yl]-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide Traditional Name: N-[5-(1-adamantyl)isoxazol-3-yl]-2-(mandeloylamino)valeramide Formula: C26H33N3O4 MolecularWeight: 451.55792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=NOC(=C1)C23CC4CC(C2)CC(C4)C3)NC(=O)C(C5=CC=CC=C5)O

Isomeric SMILES

CCCC(C(=O)NC1=NOC(=C1)C23CC4CC(C2)CC(C4)C3)NC(=O)C(C5=CC=CC=C5)O

InChI

InChI=1S/C26H33N3O4/c1-2-6-20(27-25(32)23(30)19-7-4-3-5-8-19)24(31)28-22-12-21(33-29-22)26-13-16-9-17(14-26)11-18(10-16)15-26/h3-5,7-8,12,16-18,20,23,30H,2,6,9-11,13-15H2,1H3,(H,27,32)(H,28,29,31)