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

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-N6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-N6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-N6-methyl-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-N-methyl-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: 1,3-benzodioxol-5-yl-[6-(methylamino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H16N6O2/c1-20-19-23-17(22-12-7-8-15-16(9-12)27-11-26-15)14-10-21-25(18(14)24-19)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H2,20,22,23,24)