(2S)-N-[(2S,3R)-1-cyclohexyl-6-methyl-3-oxidanyl-heptan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide

Systemtic Name: (2S)-N-[(2S,3R)-1-cyclohexyl-6-methyl-3-oxidanyl-heptan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide Openeye Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-5-methyl-hexyl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide CAS Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-6-methylheptan-2-yl]-4-methyl-2-[(1-oxo-2-phenylethyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-6-methylheptan-2-yl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide Traditional Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-5-methyl-hexyl]-4-methyl-2-[(2-phenylacetyl)amino]valeramide Formula: C28H46N2O3 MolecularWeight: 458.67644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(CC1CCCCC1)NC(=O)C(CC(C)C)NC(=O)CC2=CC=CC=C2)O

Isomeric SMILES

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

InChI

InChI=1S/C28H46N2O3/c1-20(2)15-16-26(31)24(18-22-11-7-5-8-12-22)30-28(33)25(17-21(3)4)29-27(32)19-23-13-9-6-10-14-23/h6,9-10,13-14,20-22,24-26,31H,5,7-8,11-12,15-19H2,1-4H3,(H,29,32)(H,30,33)/t24-,25-,26+/m0/s1