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

Systemtic Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-oxidanyl-4-oxidanylidene-heptan-2-yl]-4-methyl-2-(4-methylpentanoylamino)pentanamide Openeye Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-oxo-hexyl]-4-methyl-2-(4-methylpentanoylamino)pentanamide CAS Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-oxoheptan-2-yl]-4-methyl-2-[(4-methyl-1-oxopentyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-4-oxoheptan-2-yl]-4-methyl-2-(4-methylpentanoylamino)pentanamide Traditional Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-keto-hexyl]-4-methyl-2-(4-methylpentanoylamino)valeramide Formula: C25H46N2O4 MolecularWeight: 438.64374

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C(CC1CCCCC1)NC(=O)C(CC(C)C)NC(=O)CCC(C)C)O

Isomeric SMILES

CCCC(=O)[C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)CCC(C)C)O

InChI

InChI=1S/C25H46N2O4/c1-6-10-22(28)24(30)20(16-19-11-8-7-9-12-19)27-25(31)21(15-18(4)5)26-23(29)14-13-17(2)3/h17-21,24,30H,6-16H2,1-5H3,(H,26,29)(H,27,31)/t20-,21-,24+/m0/s1