N-[(2S)-3-cyclohexyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]-2-(2-methylpropyl)-4-oxidanyl-5-sulfanyl-pentanamide

Systemtic Name: N-[(2S)-3-cyclohexyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]-2-(2-methylpropyl)-4-oxidanyl-5-sulfanyl-pentanamide Openeye Name: N-[(1S)-1-(cyclohexylmethyl)-2-oxo-2-(phenethylamino)ethyl]-4-hydroxy-2-isobutyl-5-sulfanyl-pentanamide CAS Name: N-[(2S)-3-cyclohexyl-1-oxo-1-(phenethylamino)propan-2-yl]-4-hydroxy-5-mercapto-2-(2-methylpropyl)pentanamide IUPAC Name: N-[(2S)-3-cyclohexyl-1-oxo-1-(phenethylamino)propan-2-yl]-4-hydroxy-2-(2-methylpropyl)-5-sulfanylpentanamide Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-keto-2-(phenethylamino)ethyl]-4-hydroxy-2-isobutyl-5-mercapto-valeramide Formula: C26H42N2O3S MolecularWeight: 462.68828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(CS)O)C(=O)NC(CC1CCCCC1)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(CC(CS)O)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C26H42N2O3S/c1-19(2)15-22(17-23(29)18-32)25(30)28-24(16-21-11-7-4-8-12-21)26(31)27-14-13-20-9-5-3-6-10-20/h3,5-6,9-10,19,21-24,29,32H,4,7-8,11-18H2,1-2H3,(H,27,31)(H,28,30)/t22?,23?,24-/m0/s1