5-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H13BrN4O3 MolecularWeight: 425.23552

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5)Br

InChI

InChI=1S/C19H13BrN4O3/c20-15-7-17-16(26-11-27-17)6-12(15)9-23-10-21-18-14(19(23)25)8-22-24(18)13-4-2-1-3-5-13/h1-8,10H,9,11H2