N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromanyl-pyridine-3-carboxamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromo-pyridine-3-carboxamide CAS Name: N-[(2,1,3-benzothiadiazol-4-ylamino)-sulfanylidenemethyl]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-5-bromopyridine-3-carboxamide Traditional Name: 5-bromo-N-(piazthiol-4-ylthiocarbamoyl)nicotinamide Formula: C13H8BrN5OS2 MolecularWeight: 394.26952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)NC(=S)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)NC(=S)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C13H8BrN5OS2/c14-8-4-7(5-15-6-8)12(20)17-13(21)16-9-2-1-3-10-11(9)19-22-18-10/h1-6H,(H2,16,17,20,21)