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

Systemtic Name: 4-[4-chloranyl-2-(trifluoromethyl)phenyl]-5-cyclopropyl-1,2,4-triazole-3-thiolate Openeye Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cyclopropyl-1,2,4-triazole-3-thiolate CAS Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cyclopropyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cyclopropyl-1,2,4-triazole-3-thiolate Traditional Name: 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cyclopropyl-1,2,4-triazole-3-thiolate Formula: C12H8ClF3N3S- MolecularWeight: 318.72523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(F)(F)F)[S-]

Isomeric SMILES

C1CC1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(F)(F)F)[S-]

InChI

InChI=1S/C12H9ClF3N3S/c13-7-3-4-9(8(5-7)12(14,15)16)19-10(6-1-2-6)17-18-11(19)20/h3-6H,1-2H2,(H,18,20)/p-1