N-[(2-chloranylpyridin-3-yl)carbamothioyl]-3-fluoranyl-benzamide

Systemtic Name: N-[(2-chloranylpyridin-3-yl)carbamothioyl]-3-fluoranyl-benzamide Openeye Name: N-[(2-chloro-3-pyridyl)carbamothioyl]-3-fluoro-benzamide CAS Name: N-[[(2-chloro-3-pyridinyl)amino]-sulfanylidenemethyl]-3-fluorobenzamide IUPAC Name: N-[(2-chloropyridin-3-yl)carbamothioyl]-3-fluorobenzamide Traditional Name: N-[(2-chloro-3-pyridyl)thiocarbamoyl]-3-fluoro-benzamide Formula: C13H9ClFN3OS MolecularWeight: 309.746463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=O)NC(=S)NC2=C(N=CC=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=O)NC(=S)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C13H9ClFN3OS/c14-11-10(5-2-6-16-11)17-13(20)18-12(19)8-3-1-4-9(15)7-8/h1-7H,(H2,17,18,19,20)