4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-dimethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-dimethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-dimethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N,N-dimethyl-1-phenyl-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-dimethyl-1-phenylpyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: dimethyl-[1-phenyl-4-(4-piperonylpiperazino)pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C25H27N7O2 MolecularWeight: 457.52758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H27N7O2/c1-29(2)25-27-23(20-15-26-32(24(20)28-25)19-6-4-3-5-7-19)31-12-10-30(11-13-31)16-18-8-9-21-22(14-18)34-17-33-21/h3-9,14-15H,10-13,16-17H2,1-2H3