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

Systemtic Name: 5-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-[4-(1H-indol-3-yl)-1-piperidyl]-2-oxo-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-[4-(1H-indol-3-yl)-1-piperidinyl]-2-oxoethyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxoethyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-[4-(1H-indol-3-yl)piperidino]-2-keto-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCC(CC3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCC(CC3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C21H22N6O2/c1-25-20-17(11-24-25)21(29)27(13-23-20)12-19(28)26-8-6-14(7-9-26)16-10-22-18-5-3-2-4-15(16)18/h2-5,10-11,13-14,22H,6-9,12H2,1H3