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

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-imidazol-1-yl-benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-imidazol-1-yl-benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(1-imidazolyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-imidazol-1-ylbenzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-imidazol-1-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)N2C=CN=C2

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)N2C=CN=C2

InChI

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