N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)-[(E)-piperonylideneamino]amine Formula: C19H14N6O2 MolecularWeight: 358.35346

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C19H14N6O2/c1-2-4-14(5-3-1)25-19-15(10-23-25)18(20-11-21-19)24-22-9-13-6-7-16-17(8-13)27-12-26-16/h1-11H,12H2,(H,20,21,24)/b22-9+