2-[4-(4-methylphenyl)-6-phenyl-pyrimidin-2-yl]-5-phenyl-pyrazol-3-olate

Systemtic Name: 2-[4-(4-methylphenyl)-6-phenyl-pyrimidin-2-yl]-5-phenyl-pyrazol-3-olate Openeye Name: 5-phenyl-2-[4-phenyl-6-(p-tolyl)pyrimidin-2-yl]pyrazol-3-olate CAS Name: 2-[4-(4-methylphenyl)-6-phenyl-2-pyrimidinyl]-5-phenyl-3-pyrazololate IUPAC Name: 2-[4-(4-methylphenyl)-6-phenylpyrimidin-2-yl]-5-phenylpyrazol-3-olate Traditional Name: 5-phenyl-2-[4-phenyl-6-(p-tolyl)pyrimidin-2-yl]pyrazol-3-olate Formula: C26H19N4O- MolecularWeight: 403.45526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)N4C(=CC(=N4)C5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)N4C(=CC(=N4)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C26H20N4O/c1-18-12-14-21(15-13-18)23-16-22(19-8-4-2-5-9-19)27-26(28-23)30-25(31)17-24(29-30)20-10-6-3-7-11-20/h2-17,31H,1H3/p-1