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

Systemtic Name: 4-[2-chloranyl-5-(trifluoromethyl)phenyl]-5-pyridin-3-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(3-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-pyridin-3-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(3-pyridyl)-1,2,4-triazole-3-thiolate Formula: C14H7ClF3N4S- MolecularWeight: 355.74539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)[S-]

Isomeric SMILES

C1=CC(=CN=C1)C2=NN=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)[S-]

InChI

InChI=1S/C14H8ClF3N4S/c15-10-4-3-9(14(16,17)18)6-11(10)22-12(20-21-13(22)23)8-2-1-5-19-7-8/h1-7H,(H,21,23)/p-1