(2S)-N-[(2S)-3-cyclohexyl-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide

Systemtic Name: (2S)-N-[(2S)-3-cyclohexyl-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]-4-methyl-2-(2-phenylethanoylamino)pentanamide Openeye Name: (2S)-N-[(1S)-1-(cyclohexylmethyl)-2-(dimethylamino)-2-oxo-ethyl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide CAS Name: (2S)-N-[(2S)-3-cyclohexyl-1-(dimethylamino)-1-oxopropan-2-yl]-4-methyl-2-[(1-oxo-2-phenylethyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S)-3-cyclohexyl-1-(dimethylamino)-1-oxopropan-2-yl]-4-methyl-2-[(2-phenylacetyl)amino]pentanamide Traditional Name: (2S)-N-[(1S)-1-(cyclohexylmethyl)-2-(dimethylamino)-2-keto-ethyl]-4-methyl-2-[(2-phenylacetyl)amino]valeramide Formula: C25H39N3O3 MolecularWeight: 429.59546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39N3O3/c1-18(2)15-21(26-23(29)17-20-13-9-6-10-14-20)24(30)27-22(25(31)28(3)4)16-19-11-7-5-8-12-19/h6,9-10,13-14,18-19,21-22H,5,7-8,11-12,15-17H2,1-4H3,(H,26,29)(H,27,30)/t21-,22-/m0/s1