N-[3-cyclohexyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]-4-methyl-2-(2-sulfanylethanoyl)pentanamide

Systemtic Name: N-[3-cyclohexyl-1-oxidanylidene-1-(phenethylamino)propan-2-yl]-4-methyl-2-(2-sulfanylethanoyl)pentanamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-(phenethylamino)ethyl]-4-methyl-2-(2-sulfanylacetyl)pentanamide CAS Name: N-[3-cyclohexyl-1-oxo-1-(phenethylamino)propan-2-yl]-2-(2-mercapto-1-oxoethyl)-4-methylpentanamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-(phenethylamino)propan-2-yl]-4-methyl-2-(2-sulfanylacetyl)pentanamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-(phenethylamino)ethyl]-2-(2-mercaptoacetyl)-4-methyl-valeramide Formula: C25H38N2O3S MolecularWeight: 446.64582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38N2O3S/c1-18(2)15-21(23(28)17-31)24(29)27-22(16-20-11-7-4-8-12-20)25(30)26-14-13-19-9-5-3-6-10-19/h3,5-6,9-10,18,20-22,31H,4,7-8,11-17H2,1-2H3,(H,26,30)(H,27,29)