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

Systemtic Name: 3-pyridin-3-yl-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-pyridyl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-pyridinyl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-pyridin-3-yl-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-pyridyl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Formula: C14H9F3N4S MolecularWeight: 322.30827

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)N2C(=NNC2=S)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)N2C(=NNC2=S)C3=CN=CC=C3

InChI

InChI=1S/C14H9F3N4S/c15-14(16,17)10-5-1-2-6-11(10)21-12(19-20-13(21)22)9-4-3-7-18-8-9/h1-8H,(H,20,22)