N-(1,3-benzodioxol-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-(1,3-benzodioxol-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl(1H-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C12H9N5O2 MolecularWeight: 255.23216

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC=NC4=C3C=NN4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C12H9N5O2/c1-2-9-10(19-6-18-9)3-7(1)16-11-8-4-15-17-12(8)14-5-13-11/h1-5H,6H2,(H2,13,14,15,16,17)