N-(cyanomethyl)-4-[3-(1,3-thiazol-2-yl)phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-[3-(1,3-thiazol-2-yl)phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-(3-thiazol-2-ylphenyl)pentanamide CAS Name: N-(cyanomethyl)-4-[3-(2-thiazolyl)phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-[3-(1,3-thiazol-2-yl)phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-(3-thiazol-2-ylphenyl)valeramide Formula: C16H17N3OS MolecularWeight: 299.39068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NCC#N)C1=CC=CC(=C1)C2=NC=CS2

Isomeric SMILES

CC(CCC(=O)NCC#N)C1=CC=CC(=C1)C2=NC=CS2

InChI

InChI=1S/C16H17N3OS/c1-12(5-6-15(20)18-8-7-17)13-3-2-4-14(11-13)16-19-9-10-21-16/h2-4,9-12H,5-6,8H2,1H3,(H,18,20)