N-(2,1,3-Benzothiadiazol-4-Yl)-1H-1,2,4-Triazole-5-Carboxamide
[CAS# 442650-53-5]

Identification

• Name: N-(2,1,3-Benzothiadiazol-4-Yl)-1H-1,2,4-Triazole-5-Carboxamide
• Synonyms: 1H-[1,2,4]Triazole-3-carboxylic acid benzo[1,2,5]thiadiazol-4-ylamide; N-(benzo[c][1,2,5]thiadiazol-4-yl)-1H-1,2,4-triazole-3-carboxamide; N-2,1,3-benzothiadiazol-4-yl-1H-1,2,4-triazole-3-carboxamide
• Molecular Formula: C₉H₆N₆OS
• Molecular Weight: 246.25
• CAS Registry Number: 442650-53-5
• SMILES: O=C(c1ncnn1)Nc2cccc3nsnc23
• InChI: 1S/C9H6N6OS/c16-9(8-10-4-11-13-8)12-5-2-1-3-6-7(5)15-17-14-6/h1-4H,(H,12,16)(H,10,11,13)
• InChIKey: JMUCTUCUQPXZKW-UHFFFAOYSA-N

Properties

• Density: 1.721g/cm³ (Cal.)
• Refractive index: 1.848 (Cal.)