2-methylsulfanyl-4-[6-[2,2,2-tris(fluoranyl)ethoxy]pyridin-3-yl]pyridazin-3-one

Systemtic Name: 2-methylsulfanyl-4-[6-[2,2,2-tris(fluoranyl)ethoxy]pyridin-3-yl]pyridazin-3-one Openeye Name: 2-methylsulfanyl-4-[6-(2,2,2-trifluoroethoxy)-3-pyridyl]pyridazin-3-one CAS Name: 2-(methylthio)-4-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-3-pyridazinone IUPAC Name: 2-methylsulfanyl-4-[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridazin-3-one Traditional Name: 2-(methylthio)-4-[6-(2,2,2-trifluoroethoxy)-3-pyridyl]pyridazin-3-one Formula: C12H10F3N3O2S MolecularWeight: 317.28691

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Descriptors Computed from Structure

Canonical SMILES:

CSN1C(=O)C(=CC=N1)C2=CN=C(C=C2)OCC(F)(F)F

Isomeric SMILES

CSN1C(=O)C(=CC=N1)C2=CN=C(C=C2)OCC(F)(F)F

InChI

InChI=1S/C12H10F3N3O2S/c1-21-18-11(19)9(4-5-17-18)8-2-3-10(16-6-8)20-7-12(13,14)15/h2-6H,7H2,1H3