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

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-pyrrol-1-yl-benzamide Formula: C19H22N4O2 MolecularWeight: 338.40358

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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=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O2/c1-14(2)13-17(19(25)21-10-9-20)22-18(24)15-5-7-16(8-6-15)23-11-3-4-12-23/h3-8,11-12,14,17H,10,13H2,1-2H3,(H,21,25)(H,22,24)