6-[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]pyridazin-3-olate

Systemtic Name: 6-[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]pyridazin-3-olate Openeye Name: 6-[4-(2-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]pyridazin-3-olate CAS Name: 6-[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-3-pyridazinolate IUPAC Name: 6-[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]pyridazin-3-olate Traditional Name: 6-[4-(2-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]pyridazin-3-olate Formula: C12H7ClN5OS- MolecularWeight: 304.73488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=NNC2=S)C3=NN=C(C=C3)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=NNC2=S)C3=NN=C(C=C3)[O-])Cl

InChI

InChI=1S/C12H8ClN5OS/c13-7-3-1-2-4-9(7)18-11(16-17-12(18)20)8-5-6-10(19)15-14-8/h1-6H,(H,15,19)(H,17,20)/p-1