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

Systemtic Name: 3-pyridin-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-pyridyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-pyridinyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-pyridin-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-pyridyl)-4-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazole-5-thione Formula: C15H11F3N4S MolecularWeight: 336.33485

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NNC(=S)N2CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)C2=NNC(=S)N2CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C15H11F3N4S/c16-15(17,18)11-5-3-4-10(8-11)9-22-13(20-21-14(22)23)12-6-1-2-7-19-12/h1-8H,9H2,(H,21,23)