2-(5-bromanylpyridin-3-yl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-(5-bromanylpyridin-3-yl)-5-methyl-1H-pyrazol-3-one Openeye Name: 2-(5-bromo-3-pyridyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-(5-bromo-3-pyridinyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-(5-bromopyridin-3-yl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(5-bromo-3-pyridyl)-5-methyl-3-pyrazolin-3-one Formula: C9H8BrN3O MolecularWeight: 254.08332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC(=CN=C2)Br

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC(=CN=C2)Br

InChI

InChI=1S/C9H8BrN3O/c1-6-2-9(14)13(12-6)8-3-7(10)4-11-5-8/h2-5,12H,1H3