N-[3-(1H-imidazol-5-yl)-1-[(4-methyl-1-oxidanylidene-pentan-2-yl)amino]-1-oxidanylidene-propan-2-yl]-2-(naphthalen-1-ylmethyl)-8-phenyl-octanamide

Systemtic Name: N-[3-(1H-imidazol-5-yl)-1-[(4-methyl-1-oxidanylidene-pentan-2-yl)amino]-1-oxidanylidene-propan-2-yl]-2-(naphthalen-1-ylmethyl)-8-phenyl-octanamide Openeye Name: N-[2-[(1-formyl-3-methyl-butyl)amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]-2-(1-naphthylmethyl)-8-phenyl-octanamide CAS Name: N-[3-(1H-imidazol-5-yl)-1-[(4-methyl-1-oxopentan-2-yl)amino]-1-oxopropan-2-yl]-2-(1-naphthalenylmethyl)-8-phenyloctanamide IUPAC Name: N-[3-(1H-imidazol-5-yl)-1-[(4-methyl-1-oxopentan-2-yl)amino]-1-oxopropan-2-yl]-2-(naphthalen-1-ylmethyl)-8-phenyloctanamide Traditional Name: N-[2-[(1-formyl-3-methyl-butyl)amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]-2-(1-naphthylmethyl)-8-phenyl-caprylamide Formula: C37H46N4O3 MolecularWeight: 594.78614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CCCCCCC2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CC(C=O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CCCCCCC2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C37H46N4O3/c1-27(2)21-33(25-42)40-37(44)35(23-32-24-38-26-39-32)41-36(43)31(17-9-4-3-6-13-28-14-7-5-8-15-28)22-30-19-12-18-29-16-10-11-20-34(29)30/h5,7-8,10-12,14-16,18-20,24-27,31,33,35H,3-4,6,9,13,17,21-23H2,1-2H3,(H,38,39)(H,40,44)(H,41,43)