5-bromanyl-N-[(4-fluorophenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-fluorophenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(4-fluorophenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(4-fluoroanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(4-fluorophenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(4-fluorophenyl)thiocarbamoyl]nicotinamide Formula: C13H9BrFN3OS MolecularWeight: 354.197463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=CN=C2)Br)F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=CN=C2)Br)F

InChI

InChI=1S/C13H9BrFN3OS/c14-9-5-8(6-16-7-9)12(19)18-13(20)17-11-3-1-10(15)2-4-11/h1-7H,(H2,17,18,19,20)