N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(3-pyridylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(3-pyridinylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-1-phenyl-6-N-(pyridin-3-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: 1,3-benzodioxol-5-yl-[1-phenyl-6-(3-pyridylmethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C24H19N7O2 MolecularWeight: 437.45336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)NCC6=CN=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)NCC6=CN=CC=C6

InChI

InChI=1S/C24H19N7O2/c1-2-6-18(7-3-1)31-23-19(14-27-31)22(28-17-8-9-20-21(11-17)33-15-32-20)29-24(30-23)26-13-16-5-4-10-25-12-16/h1-12,14H,13,15H2,(H2,26,28,29,30)