2-chloranyl-N-(pyridin-4-ylmethylcarbamothioyl)benzamide

Systemtic Name: 2-chloranyl-N-(pyridin-4-ylmethylcarbamothioyl)benzamide Openeye Name: 2-chloro-N-(4-pyridylmethylcarbamothioyl)benzamide CAS Name: 2-chloro-N-[(pyridin-4-ylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-N-(pyridin-4-ylmethylcarbamothioyl)benzamide Traditional Name: 2-chloro-N-(4-pyridylmethylthiocarbamoyl)benzamide Formula: C14H12ClN3OS MolecularWeight: 305.78258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NCC2=CC=NC=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NCC2=CC=NC=C2)Cl

InChI

InChI=1S/C14H12ClN3OS/c15-12-4-2-1-3-11(12)13(19)18-14(20)17-9-10-5-7-16-8-6-10/h1-8H,9H2,(H2,17,18,19,20)