(2S)-N-(cyanomethyl)-4-methyl-2-[(4-morpholin-4-ylpyrimidin-2-yl)amino]pentanamide

Systemtic Name: (2S)-N-(cyanomethyl)-4-methyl-2-[(4-morpholin-4-ylpyrimidin-2-yl)amino]pentanamide Openeye Name: (2S)-N-(cyanomethyl)-4-methyl-2-[(4-morpholinopyrimidin-2-yl)amino]pentanamide CAS Name: (2S)-N-(cyanomethyl)-4-methyl-2-[[4-(4-morpholinyl)-2-pyrimidinyl]amino]pentanamide IUPAC Name: (2S)-N-(cyanomethyl)-4-methyl-2-[(4-morpholin-4-ylpyrimidin-2-yl)amino]pentanamide Traditional Name: (2S)-N-(cyanomethyl)-4-methyl-2-[(4-morpholinopyrimidin-2-yl)amino]valeramide Formula: C16H24N6O2 MolecularWeight: 332.40076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC1=NC=CC(=N1)N2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC1=NC=CC(=N1)N2CCOCC2

InChI

InChI=1S/C16H24N6O2/c1-12(2)11-13(15(23)18-6-4-17)20-16-19-5-3-14(21-16)22-7-9-24-10-8-22/h3,5,12-13H,6-11H2,1-2H3,(H,18,23)(H,19,20,21)/t13-/m0/s1