(4E)-5-methyl-2-(4-methylphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]pyrazol-3-one

Systemtic Name: (4E)-5-methyl-2-(4-methylphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]pyrazol-3-one Openeye Name: (4E)-5-methyl-4-[(1-methylpyrazol-4-yl)methylene]-2-(p-tolyl)pyrazol-3-one CAS Name: (4E)-5-methyl-2-(4-methylphenyl)-4-[(1-methyl-4-pyrazolyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-5-methyl-2-(4-methylphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]pyrazol-3-one Traditional Name: (4E)-5-methyl-4-[(1-methylpyrazol-4-yl)methylene]-2-(p-tolyl)-2-pyrazolin-3-one Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(N=C3)C)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CN(N=C3)C)/C(=N2)C

InChI

InChI=1S/C16H16N4O/c1-11-4-6-14(7-5-11)20-16(21)15(12(2)18-20)8-13-9-17-19(3)10-13/h4-10H,1-3H3/b15-8+