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

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C10H9ClFN3S2 MolecularWeight: 289.779963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)NN=C1SCC2=C(C=CC=C2Cl)F

Isomeric SMILES

CN1C(=S)NN=C1SCC2=C(C=CC=C2Cl)F

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)