N-(pyridin-3-ylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-(pyridin-3-ylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-(3-pyridylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[(3-pyridinylamino)-sulfanylidenemethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-(pyridin-3-ylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-(3-pyridylthiocarbamoyl)piazthiole-5-carboxamide Formula: C13H9N5OS2 MolecularWeight: 315.37346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=S)NC(=O)C2=CC3=NSN=C3C=C2

Isomeric SMILES

C1=CC(=CN=C1)NC(=S)NC(=O)C2=CC3=NSN=C3C=C2

InChI

InChI=1S/C13H9N5OS2/c19-12(8-3-4-10-11(6-8)18-21-17-10)16-13(20)15-9-2-1-5-14-7-9/h1-7H,(H2,15,16,19,20)