N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-(1H-imidazol-2-yl)benzamide

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-(1H-imidazol-2-yl)benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(1H-imidazol-2-yl)benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(1H-imidazol-2-yl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(1H-imidazol-2-yl)benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(1H-imidazol-2-yl)benzamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)C2=NC=CN2

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)C2=NC=CN2

InChI

InChI=1S/C18H21N5O2/c1-12(2)11-15(18(25)22-8-7-19)23-17(24)14-5-3-13(4-6-14)16-20-9-10-21-16/h3-6,9-10,12,15H,8,11H2,1-2H3,(H,20,21)(H,22,25)(H,23,24)