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

Systemtic Name: (2S)-N-[(2S,3R)-1-cyclohexyl-5-methyl-3-oxidanyl-4-oxidanylidene-hexan-2-yl]-4-methyl-2-(4-methylpentanoylamino)pentanamide Openeye Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-4-methyl-3-oxo-pentyl]-4-methyl-2-(4-methylpentanoylamino)pentanamide CAS Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-5-methyl-4-oxohexan-2-yl]-4-methyl-2-[(4-methyl-1-oxopentyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S,3R)-1-cyclohexyl-3-hydroxy-5-methyl-4-oxohexan-2-yl]-4-methyl-2-(4-methylpentanoylamino)pentanamide Traditional Name: (2S)-N-[(1S,2R)-1-(cyclohexylmethyl)-2-hydroxy-3-keto-4-methyl-pentyl]-4-methyl-2-(4-methylpentanoylamino)valeramide Formula: C25H46N2O4 MolecularWeight: 438.64374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H46N2O4/c1-16(2)12-13-22(28)26-21(14-17(3)4)25(31)27-20(24(30)23(29)18(5)6)15-19-10-8-7-9-11-19/h16-21,24,30H,7-15H2,1-6H3,(H,26,28)(H,27,31)/t20-,21-,24+/m0/s1