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

Systemtic Name: 4-methyl-3-[[2-(trifluoromethyl)quinolin-4-yl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-methyl-3-[[2-(trifluoromethyl)-4-quinolyl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-methyl-3-[[[2-(trifluoromethyl)-4-quinolinyl]thio]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-methyl-3-[[2-(trifluoromethyl)quinolin-4-yl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-methyl-3-[[[2-(trifluoromethyl)-4-quinolyl]thio]methyl]-1H-1,2,4-triazole-5-thione Formula: C14H11F3N4S2 MolecularWeight: 356.38915

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CSC2=CC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CN1C(=NNC1=S)CSC2=CC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C14H11F3N4S2/c1-21-12(19-20-13(21)22)7-23-10-6-11(14(15,16)17)18-9-5-3-2-4-8(9)10/h2-6H,7H2,1H3,(H,20,22)