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

Systemtic Name: 4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]carbonyl-2-propyl-phthalazin-1-one Openeye Name: 4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]-2-propyl-phthalazin-1-one CAS Name: 4-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-oxomethyl]-2-propyl-1-phthalazinone IUPAC Name: 4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]-2-propylphthalazin-1-one Traditional Name: 4-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carbonyl]-2-propyl-phthalazin-1-one Formula: C22H24N8O2 MolecularWeight: 432.47836

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=NC=NC5=C4C=NN5C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=NC=NC5=C4C=NN5C

InChI

InChI=1S/C22H24N8O2/c1-3-8-30-21(31)16-7-5-4-6-15(16)18(26-30)22(32)29-11-9-28(10-12-29)20-17-13-25-27(2)19(17)23-14-24-20/h4-7,13-14H,3,8-12H2,1-2H3