8-Chloro-6-(2-Chlorophenyl)-1-[(4-Chlorophenyl)Sulfanylmethyl]-4H-[1,2,4]Triazolo[4,3-a][1,4]Benzodiazepine
[CAS# 72930-61-1]

Identification

• Name: 8-Chloro-6-(2-Chlorophenyl)-1-[(4-Chlorophenyl)Sulfanylmethyl]-4H-[1,2,4]Triazolo[4,3-a][1,4]Benzodiazepine
• Synonyms: 8-Chloro-6-(2-Chlorophenyl)-1-[[(4-Chlorophenyl)Thio]Methyl]-4H-[1,2,4]Triazolo[4,3-A][1,4]Benzodiazepine; Zinc02049840; Oprea1_826116
• Molecular Formula: C₂₃H₁₅Cl₃N₄S
• Molecular Weight: 485.82
• CAS Registry Number: 72930-61-1
• SMILES: C1=CC(=CC4=C1[N]2C(=NN=C2CSC3=CC=C(Cl)C=C3)CN=C4C5=CC=CC=C5Cl)Cl
• InChI: 1S/C23H15Cl3N4S/c24-14-5-8-16(9-6-14)31-13-22-29-28-21-12-27-23(17-3-1-2-4-19(17)26)18-11-15(25)7-10-20(18)30(21)22/h1-11H,12-13H2
• InChIKey: IBVLRPUJFRLXBI-UHFFFAOYSA-N

Properties

• Density: 1.484g/cm³ (Cal.)
• Boiling point: 661.119°C at 760 mmHg (Cal.)
• Flash point: 353.632°C (Cal.)