(4E)-3-butyl-4-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methylidene]-1H-pyrazol-5-one

Systemtic Name: (4E)-3-butyl-4-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methylidene]-1H-pyrazol-5-one Openeye Name: (4E)-3-butyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methylene]-1H-pyrazol-5-one CAS Name: (4E)-3-butyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]-1H-pyrazol-5-one IUPAC Name: (4E)-3-butyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]-1H-pyrazol-5-one Traditional Name: (4E)-5-butyl-4-[(3-keto-5-methyl-3-pyrazolin-4-yl)methylene]-2-pyrazolin-3-one Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NNC(=O)C1=CC2=C(NNC2=O)C

Isomeric SMILES

CCCCC\1=NNC(=O)/C1=C/C2=C(NNC2=O)C

InChI

InChI=1S/C12H16N4O2/c1-3-4-5-10-9(12(18)16-14-10)6-8-7(2)13-15-11(8)17/h6H,3-5H2,1-2H3,(H,16,18)(H2,13,15,17)/b9-6+