N-(4H-1,2,4-Triazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
[CAS# 717872-62-3]

Identification

• Name: N-(4H-1,2,4-Triazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
• Synonyms: N-(4H-1,2,4-triazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide; N-(4H-1,2,4-triazol-4-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamide; N-4H-1,2,4-triazol-4-yl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
• Molecular Formula: C₁₁H₁₂N₄OS
• Molecular Weight: 248.30
• CAS Registry Number: 717872-62-3
• SMILES: C1CCC2=C(C1)C=C(S2)C(=O)NN3C=NN=C3
• InChI: 1S/C11H12N4OS/c16-11(14-15-6-12-13-7-15)10-5-8-3-1-2-4-9(8)17-10/h5-7H,1-4H2,(H,14,16)
• InChIKey: RXTWRQKQVMERPH-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Refractive index: 1.778 (Cal.)