5-Amino-3-(4-Chlorophenyl)-N-Methyl-1,2,4-Triazole-1-Carbothioamide
[CAS# 168893-29-6]

Identification

• Name: 5-Amino-3-(4-Chlorophenyl)-N-Methyl-1,2,4-Triazole-1-Carbothioamide
• Synonyms: Gcc-Ap0341; 1H-1,2,4-Triazole-1-Carbothioamide, 5-Amino-3-(4-Chlorophenyl)-N-Methyl-; 5-Amino-3-(4-Chlorophenyl)-N-Methyl-1H-1,2,4-Triazole-1-Carbothioamide
• Molecular Formula: C₁₀H₁₀ClN₅S
• Molecular Weight: 267.74
• CAS Registry Number: 168893-29-6
• SMILES: C2=C(C1=N[N](C(=N1)N)C(=S)NC)C=CC(=C2)Cl
• InChI: 1S/C10H10ClN5S/c1-13-10(17)16-9(12)14-8(15-16)6-2-4-7(11)5-3-6/h2-5H,1H3,(H,13,17)(H2,12,14,15)
• InChIKey: PWDDJOGPFSDPEK-UHFFFAOYSA-N

Properties

• Density: 1.526g/cm³ (Cal.)
• Boiling point: 473.354°C at 760 mmHg (Cal.)
• Flash point: 240.076°C (Cal.)