6-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[2-(difluoromethylsulfanyl)phenyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[2-(difluoromethylthio)anilino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[2-(difluoromethylsulfanyl)phenyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[2-(difluoromethylthio)phenyl]carbamoyl]pyridazin-3-olate Formula: C12H8F2N3O2S- MolecularWeight: 296.272626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=NN=C(C=C2)[O-])SC(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=NN=C(C=C2)[O-])SC(F)F

InChI

InChI=1S/C12H9F2N3O2S/c13-12(14)20-9-4-2-1-3-7(9)15-11(19)8-5-6-10(18)17-16-8/h1-6,12H,(H,15,19)(H,17,18)/p-1