(2S)-N-[(2S,3R)-1-cyclohexyl-3-oxidanyl-4-oxidanylidene-5-phenyl-pentan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide

Systemtic Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-oxidanyl-4-oxidanylidene-5-phenyl-pentan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide Openeye Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-oxo-4-phenyl-butyl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide CAS Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-oxo-5-phenylpentan-2-yl]-4-methyl-2-[(1-oxo-2-phenylethyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-oxo-5-phenylpentan-2-yl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide Traditional Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-keto-4-phenyl-butyl]-4-methyl-2-[(2-phenylacetyl)amino]valeramide Formula: C31H42N2O4 MolecularWeight: 506.67618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1CCCCC1)C(C(=O)CC2=CC=CC=C2)O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](C(=O)CC2=CC=CC=C2)O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C31H42N2O4/c1-22(2)18-27(32-29(35)21-25-16-10-5-11-17-25)31(37)33-26(19-23-12-6-3-7-13-23)30(36)28(34)20-24-14-8-4-9-15-24/h4-5,8-11,14-17,22-23,26-27,30,36H,3,6-7,12-13,18-21H2,1-2H3,(H,32,35)(H,33,37)/t26-,27-,30+/m0/s1