(4E)-4-[[(5-bromanylpyridin-2-yl)amino]methylidene]-5-methyl-2-(2-methylphenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[[(5-bromanylpyridin-2-yl)amino]methylidene]-5-methyl-2-(2-methylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[[(5-bromo-2-pyridyl)amino]methylene]-5-methyl-2-(o-tolyl)pyrazol-3-one CAS Name: (4E)-4-[[(5-bromo-2-pyridinyl)amino]methylidene]-5-methyl-2-(2-methylphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[[(5-bromopyridin-2-yl)amino]methylidene]-5-methyl-2-(2-methylphenyl)pyrazol-3-one Traditional Name: (4E)-4-[[(5-bromo-2-pyridyl)amino]methylene]-5-methyl-2-(o-tolyl)-2-pyrazolin-3-one Formula: C17H15BrN4O MolecularWeight: 371.2312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CNC3=NC=C(C=C3)Br)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=C/NC3=NC=C(C=C3)Br)/C(=N2)C

InChI

InChI=1S/C17H15BrN4O/c1-11-5-3-4-6-15(11)22-17(23)14(12(2)21-22)10-20-16-8-7-13(18)9-19-16/h3-10H,1-2H3,(H,19,20)/b14-10+