3-[4-(3-chloranyl-4-fluoranyl-phenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(3-chloranyl-4-fluoranyl-phenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one Openeye Name: 3-[4-(3-chloro-4-fluoro-phenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one CAS Name: 3-[4-(3-chloro-4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(3-chloro-4-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one Traditional Name: 3-[4-(3-chloro-4-fluoro-phenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]-1H-pyridazin-6-one Formula: C12H7ClFN5OS MolecularWeight: 323.733283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C(=NNC2=S)C3=NNC(=O)C=C3)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1N2C(=NNC2=S)C3=NNC(=O)C=C3)Cl)F

InChI

InChI=1S/C12H7ClFN5OS/c13-7-5-6(1-2-8(7)14)19-11(17-18-12(19)21)9-3-4-10(20)16-15-9/h1-5H,(H,16,20)(H,18,21)