2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phthalazin-1-one

Systemtic Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phthalazin-1-one Openeye Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phthalazin-1-one CAS Name: 2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]phthalazin-1-one Traditional Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]phthalazin-1-one Formula: C19H20N8O MolecularWeight: 376.4151

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CN4C(=O)C5=CC=CC=C5C=N4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CN4C(=O)C5=CC=CC=C5C=N4

InChI

InChI=1S/C19H20N8O/c1-24-17-16(11-22-24)18(21-12-20-17)26-8-6-25(7-9-26)13-27-19(28)15-5-3-2-4-14(15)10-23-27/h2-5,10-12H,6-9,13H2,1H3