4-(1H-indol-3-yl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(1H-indol-3-yl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one Openeye Name: 4-(1H-indol-3-yl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one CAS Name: 4-(1H-indol-3-yl)-1-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(1H-indol-3-yl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one Traditional Name: 4-(1H-indol-3-yl)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]butan-1-one Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)CCCC4=CNC5=CC=CC=C54

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)CCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H25N7O/c1-27-21-18(14-26-27)22(25-15-24-21)29-11-9-28(10-12-29)20(30)8-4-5-16-13-23-19-7-3-2-6-17(16)19/h2-3,6-7,13-15,23H,4-5,8-12H2,1H3