4-[2-chloranyl-6-(trifluoromethyl)phenyl]-5-propan-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-chloranyl-6-(trifluoromethyl)phenyl]-5-propan-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-chloro-6-(trifluoromethyl)phenyl]-5-isopropyl-1,2,4-triazole-3-thiolate CAS Name: 4-[2-chloro-6-(trifluoromethyl)phenyl]-5-propan-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-chloro-6-(trifluoromethyl)phenyl]-5-propan-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-chloro-6-(trifluoromethyl)phenyl]-5-isopropyl-1,2,4-triazole-3-thiolate Formula: C12H10ClF3N3S- MolecularWeight: 320.74111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2=C(C=CC=C2Cl)C(F)(F)F)[S-]

Isomeric SMILES

CC(C)C1=NN=C(N1C2=C(C=CC=C2Cl)C(F)(F)F)[S-]

InChI

InChI=1S/C12H11ClF3N3S/c1-6(2)10-17-18-11(20)19(10)9-7(12(14,15)16)4-3-5-8(9)13/h3-6H,1-2H3,(H,18,20)/p-1