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

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-(2-methyl-1,3-thiazol-4-yl)benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(2-methylthiazol-4-yl)benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(2-methyl-4-thiazolyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(2-methyl-1,3-thiazol-4-yl)benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(2-methylthiazol-4-yl)benzamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)C(=O)NC(CC(C)C)C(=O)NCC#N

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)C(=O)NC(CC(C)C)C(=O)NCC#N

InChI

InChI=1S/C19H22N4O2S/c1-12(2)10-16(19(25)21-9-8-20)23-18(24)15-6-4-14(5-7-15)17-11-26-13(3)22-17/h4-7,11-12,16H,9-10H2,1-3H3,(H,21,25)(H,23,24)