4-(4-Chlorophenyl)-5-(Piperidin-1-Ylmethyl)-4H-1,2,4-Triazole-3-Thiol
[CAS# 65924-81-4]

Identification

• Name: 4-(4-Chlorophenyl)-5-(Piperidin-1-Ylmethyl)-4H-1,2,4-Triazole-3-Thiol
• Synonyms: 4-(4-Chlorophenyl)-5-(1-Piperidin-1-Iumylmethyl)-2H-1,2,4-Triazole-3-Thione; Zinc03887765
• Molecular Formula: C₁₄H₁₈ClN₄S
• Molecular Weight: 309.84
• CAS Registry Number: 65924-81-4
• SMILES: C3=C(N1C(=NNC1=S)C[NH+]2CCCCC2)C=CC(=C3)Cl
• InChI: 1S/C14H17ClN4S/c15-11-4-6-12(7-5-11)19-13(16-17-14(19)20)10-18-8-2-1-3-9-18/h4-7H,1-3,8-10H2,(H,17,20)/p+1
• InChIKey: HXPABTAIMOEMFI-UHFFFAOYSA-O

Properties

• Boiling point: 414.851°C at 760 mmHg (Cal.)
• Flash point: 204.695°C (Cal.)