N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-6-(4-piperidin-1-ylpiperidin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-6-(4-piperidin-1-ylpiperidin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-6-[4-(1-piperidyl)-1-piperidyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-6-[4-(1-piperidinyl)-1-piperidinyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-6-(4-piperidin-1-ylpiperidin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (2,5-dimethoxybenzyl)-[1-methyl-6-(4-piperidinopiperidino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C25H35N7O2 MolecularWeight: 465.5911

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCC(CC3)N4CCCCC4)NCC5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCC(CC3)N4CCCCC4)NCC5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C25H35N7O2/c1-30-24-21(17-27-30)23(26-16-18-15-20(33-2)7-8-22(18)34-3)28-25(29-24)32-13-9-19(10-14-32)31-11-5-4-6-12-31/h7-8,15,17,19H,4-6,9-14,16H2,1-3H3,(H,26,28,29)