2-[(5-{[(4-Chlorophenyl)Sulfanyl]Methyl}-2H-Tetrazol-2-Yl)Acetyl]-N-[2-(Trifluoromethyl)Phenyl]Hydrazinecarbothioamide
[CAS# 262296-64-0]

Identification

• Name: 2-[(5-{[(4-Chlorophenyl)Sulfanyl]Methyl}-2H-Tetrazol-2-Yl)Acetyl]-N-[2-(Trifluoromethyl)Phenyl]Hydrazinecarbothioamide
• Synonyms: 2H-TETRAZOLE-2-ACETICACID, 5-[[(4-CHLOROPHENYL)THIO]METHYL]-,2-[THIOXO[[2-(TRIFLUOROMETHYL)PHENYL]AMINO]METHYL]HYDRAZIDE
• Molecular Formula: C₁₈H₁₅ClF₃N₇OS₂
• Molecular Weight: 501.94
• CAS Registry Number: 262296-64-0
• SMILES: O=C(NNC(=S)Nc1ccccc1C(F)(F)F)Cn2nc(nn2)CSc3ccc(Cl)cc3
• InChI: 1S/C18H15ClF3N7OS2/c19-11-5-7-12(8-6-11)32-10-15-24-28-29(27-15)9-16(30)25-26-17(31)23-14-4-2-1-3-13(14)18(20,21)22/h1-8H,9-10H2,(H,25,30)(H2,23,26,31)
• InChIKey: NWFLHMJUXIPXSO-UHFFFAOYSA-N

Properties

• Density: 1.571g/cm³ (Cal.)
• Refractive index: 1.681 (Cal.)