N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-morpholin-4-yl-pyridine-4-carboxamide

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-morpholin-4-yl-pyridine-4-carboxamide Openeye Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-2-morpholino-pyridine-4-carboxamide CAS Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-2-(4-morpholinyl)-4-pyridinecarboxamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-2-morpholin-4-ylpyridine-4-carboxamide Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-2-morpholino-isonicotinamide Formula: C18H25N5O3 MolecularWeight: 359.4228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC(=NC=C1)N2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC(=O)C1=CC(=NC=C1)N2CCOCC2

InChI

InChI=1S/C18H25N5O3/c1-13(2)11-15(18(25)21-6-4-19)22-17(24)14-3-5-20-16(12-14)23-7-9-26-10-8-23/h3,5,12-13,15H,6-11H2,1-2H3,(H,21,25)(H,22,24)/t15-/m0/s1