6-[2-cyclopropyl-1-(4-methylpiperazin-1-yl)ethyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-cyclopropyl-1-(4-methylpiperazin-1-yl)ethyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzyl-6-[2-cyclopropyl-1-(4-methylpiperazin-1-yl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-cyclopropyl-1-(4-methyl-1-piperazinyl)ethyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-benzyl-6-[2-cyclopropyl-1-(4-methylpiperazin-1-yl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzyl-6-[2-cyclopropyl-1-(4-methylpiperazino)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CC2CC2)C3=NC4=C(C=NN4)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C(CC2CC2)C3=NC4=C(C=NN4)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C22H28N6O/c1-26-9-11-27(12-10-26)19(13-16-7-8-16)21-24-20-18(14-23-25-20)22(29)28(21)15-17-5-3-2-4-6-17/h2-6,14,16,19H,7-13,15H2,1H3,(H,23,25)