3-(aminomethyl)-N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: 3-(aminomethyl)-N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: 3-(aminomethyl)-N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]benzamide CAS Name: 3-(aminomethyl)-N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]benzamide IUPAC Name: 3-(aminomethyl)-N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]benzamide Traditional Name: 3-(aminomethyl)-N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]benzamide Formula: C16H22N4O2 MolecularWeight: 302.37148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O2/c1-11(2)8-14(16(22)19-7-6-17)20-15(21)13-5-3-4-12(9-13)10-18/h3-5,9,11,14H,7-8,10,18H2,1-2H3,(H,19,22)(H,20,21)/t14-/m0/s1