5-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H16BrN5O2S MolecularWeight: 494.36374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

InChI

InChI=1S/C22H16BrN5O2S/c1-30-19-8-7-14(23)9-17(19)21-26-15(12-31-21)11-27-13-24-20-18(22(27)29)10-25-28(20)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3