1-phenyl-4-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-phenyl-4-[4-[phenyl(2-pyridyl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-[4-[phenyl(2-pyridinyl)methyl]-1-piperazinyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-phenyl-4-[4-[phenyl(2-pyridyl)methyl]piperazino]pyrazolo[3,4-d]pyrimidine Formula: C27H25N7 MolecularWeight: 447.5343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=N6

InChI

InChI=1S/C27H25N7/c1-3-9-21(10-4-1)25(24-13-7-8-14-28-24)32-15-17-33(18-16-32)26-23-19-31-34(27(23)30-20-29-26)22-11-5-2-6-12-22/h1-14,19-20,25H,15-18H2