3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C15H10ClF3N4S2 MolecularWeight: 402.84491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C15H10ClF3N4S2/c16-11-6-9(15(17,18)19)7-20-13(11)25-8-12-21-22-14(24)23(12)10-4-2-1-3-5-10/h1-7H,8H2,(H,22,24)