N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(3-propan-2-yloxypropyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(3-propan-2-yloxypropyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-N6-(3-isopropoxypropyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-1-phenyl-N6-(3-propan-2-yloxypropyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-1-phenyl-6-N-(3-propan-2-yloxypropyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: 1,3-benzodioxol-5-yl-[6-(3-isopropoxypropylamino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)OCCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H26N6O3/c1-16(2)31-12-6-11-25-24-28-22(27-17-9-10-20-21(13-17)33-15-32-20)19-14-26-30(23(19)29-24)18-7-4-3-5-8-18/h3-5,7-10,13-14,16H,6,11-12,15H2,1-2H3,(H2,25,27,28,29)