5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(2-chloro-6-fluorophenyl)methylthio]-4-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(2-chloro-6-fluoro-benzyl)thio]-4-methyl-1,2,4-triazole-3-thiolate Formula: C10H8ClFN3S2- MolecularWeight: 288.772023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)[S-]

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)[S-]

InChI

InChI=1S/C10H9ClFN3S2/c1-15-9(16)13-14-10(15)17-5-6-7(11)3-2-4-8(6)12/h2-4H,5H2,1H3,(H,13,16)/p-1