5-methyl-4-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-methyl-4-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-methyl-4-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-2-phenyl-4H-pyrazol-3-one CAS Name: 5-methyl-4-(4-methyl-1-pyrazolo[3,4-d]pyrimidinyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-methyl-4-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-methyl-4-(4-methylpyrazolo[3,4-d]pyrimidin-1-yl)-2-phenyl-2-pyrazolin-3-one Formula: C16H14N6O MolecularWeight: 306.32196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N2C3=NC=NC(=C3C=N2)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1N2C3=NC=NC(=C3C=N2)C)C4=CC=CC=C4

InChI

InChI=1S/C16H14N6O/c1-10-13-8-19-22(15(13)18-9-17-10)14-11(2)20-21(16(14)23)12-6-4-3-5-7-12/h3-9,14H,1-2H3