5-(4-bromophenyl)-6-(2-fluorophenyl)-1-pyridin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-(2-fluorophenyl)-1-pyridin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-(2-fluorophenyl)-1-(2-pyridyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-(2-fluorophenyl)-1-(2-pyridinyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-(2-fluorophenyl)-1-pyridin-2-ylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-(2-fluorophenyl)-1-(2-pyridyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H13BrFN5O MolecularWeight: 462.273923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C4=CC=CC=N4)C(=O)N2C5=CC=C(C=C5)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C4=CC=CC=N4)C(=O)N2C5=CC=C(C=C5)Br)F

InChI

InChI=1S/C22H13BrFN5O/c23-14-8-10-15(11-9-14)28-20(16-5-1-2-6-18(16)24)27-21-17(22(28)30)13-26-29(21)19-7-3-4-12-25-19/h1-13H