1-methyl-5-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-methyl-5-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-methyl-5-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-methyl-5-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-methyl-5-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H18N8O2 MolecularWeight: 354.36652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C16H18N8O2/c1-21-14-12(9-20-21)15(26)24(11-19-14)10-13(25)22-5-7-23(8-6-22)16-17-3-2-4-18-16/h2-4,9,11H,5-8,10H2,1H3