N-[3-[(4,5-Dihydro-5-Thioxo-1H-Tetrazol)-1-Yl]Phenyl]Hexanamide
[CAS# 14070-49-6]

Identification

• Name: N-[3-[(4,5-Dihydro-5-Thioxo-1H-Tetrazol)-1-Yl]Phenyl]Hexanamide
• Synonyms: N-[3-(5-Thioxo-2H-Tetrazol-1-Yl)Phenyl]Hexanamide; N-[3-(5-Sulfanylidene-2H-1,2,3,4-Tetrazol-1-Yl)Phenyl]Hexanamide; 1-(3-Hexanoylamidophenyl)-1H-Tetrazole-5-Thiol
• Molecular Formula: C₁₃H₁₇N₅OS
• Molecular Weight: 291.37
• CAS Registry Number: 14070-49-6
• SMILES: C1=C(NC(=O)CCCCC)C=CC=C1N2NN=NC2=S
• InChI: 1S/C13H17N5OS/c1-2-3-4-8-12(19)14-10-6-5-7-11(9-10)18-13(20)15-16-17-18/h5-7,9H,2-4,8H2,1H3,(H,14,19)(H,15,17,20)
• InChIKey: YWOUQJSJOIEEIW-UHFFFAOYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)