5-[1,1-bis(fluoranyl)ethyl]-2-(5-bromanyl-3,6-dimethyl-pyridin-2-yl)pyridazin-3-one

Systemtic Name: 5-[1,1-bis(fluoranyl)ethyl]-2-(5-bromanyl-3,6-dimethyl-pyridin-2-yl)pyridazin-3-one Openeye Name: 2-(5-bromo-3,6-dimethyl-2-pyridyl)-5-(1,1-difluoroethyl)pyridazin-3-one CAS Name: 2-(5-bromo-3,6-dimethyl-2-pyridinyl)-5-(1,1-difluoroethyl)-3-pyridazinone IUPAC Name: 2-(5-bromo-3,6-dimethylpyridin-2-yl)-5-(1,1-difluoroethyl)pyridazin-3-one Traditional Name: 2-(5-bromo-3,6-dimethyl-2-pyridyl)-5-(1,1-difluoroethyl)pyridazin-3-one Formula: C13H12BrF2N3O MolecularWeight: 344.154686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1N2C(=O)C=C(C=N2)C(C)(F)F)C)Br

Isomeric SMILES

CC1=CC(=C(N=C1N2C(=O)C=C(C=N2)C(C)(F)F)C)Br

InChI

InChI=1S/C13H12BrF2N3O/c1-7-4-10(14)8(2)18-12(7)19-11(20)5-9(6-17-19)13(3,15)16/h4-6H,1-3H3