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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C18H12FN5O2 MolecularWeight: 349.318583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12FN5O2/c19-11-1-4-13(5-2-11)24-18-14(8-22-24)17(20-9-21-18)23-12-3-6-15-16(7-12)26-10-25-15/h1-9H,10H2,(H,20,21,23)