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

Systemtic Name: 5-[2-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]-2-oxo-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidinyl]-2-oxoethyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-2-oxoethyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-keto-2-[4-(2-p-phenetylethyl)piperidino]ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C23H29N5O3/c1-3-31-19-8-6-17(7-9-19)4-5-18-10-12-27(13-11-18)21(29)15-28-16-24-22-20(23(28)30)14-25-26(22)2/h6-9,14,16,18H,3-5,10-13,15H2,1-2H3