5-[3-(3,5-dimethylpiperidin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[3-(3,5-dimethylpiperidin-1-yl)-3-oxidanylidene-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(3,5-dimethyl-1-piperidyl)-3-oxo-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[3-(3,5-dimethyl-1-piperidinyl)-3-oxopropyl]-6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[3-(3,5-dimethylpiperidin-1-yl)-3-oxopropyl]-6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(3,5-dimethylpiperidino)-3-keto-propyl]-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CCN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)C

InChI

InChI=1S/C22H27N5O2/c1-15-11-16(2)14-25(13-15)20(28)9-10-26-17(3)24-21-19(22(26)29)12-23-27(21)18-7-5-4-6-8-18/h4-8,12,15-16H,9-11,13-14H2,1-3H3