2-[(2-azanyl-3-phenyl-propanoyl)-(3-methylbutanoyl)amino]-N-[1-cyclohexyl-3-(cyclohexylmethylimino)propan-2-yl]pentanamide

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)-(3-methylbutanoyl)amino]-N-[1-cyclohexyl-3-(cyclohexylmethylimino)propan-2-yl]pentanamide Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)-(3-methylbutanoyl)amino]-N-[1-(cyclohexylmethyl)-2-(cyclohexylmethylimino)ethyl]pentanamide CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)-(3-methyl-1-oxobutyl)amino]-N-[1-cyclohexyl-3-(cyclohexylmethylimino)propan-2-yl]pentanamide IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)-(3-methylbutanoyl)amino]-N-[1-cyclohexyl-3-(cyclohexylmethylimino)propan-2-yl]pentanamide Traditional Name: N-[1-(cyclohexylmethyl)-2-(cyclohexylmethylimino)ethyl]-2-[isovaleryl(phenylalanyl)amino]valeramide Formula: C35H56N4O3 MolecularWeight: 580.84414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CC1CCCCC1)C=NCC2CCCCC2)N(C(=O)CC(C)C)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CCCC(C(=O)NC(CC1CCCCC1)C=NCC2CCCCC2)N(C(=O)CC(C)C)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C35H56N4O3/c1-4-14-32(39(33(40)21-26(2)3)35(42)31(36)23-28-17-10-6-11-18-28)34(41)38-30(22-27-15-8-5-9-16-27)25-37-24-29-19-12-7-13-20-29/h6,10-11,17-18,25-27,29-32H,4-5,7-9,12-16,19-24,36H2,1-3H3,(H,38,41)