4-bromanyl-N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]benzamide

Systemtic Name: 4-bromanyl-N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]benzamide Openeye Name: 4-bromo-N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]benzamide CAS Name: 4-bromo-N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-3-pyrazolyl]benzamide IUPAC Name: 4-bromo-N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]benzamide Traditional Name: 4-bromo-N-[2-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-5-methyl-pyrazol-3-yl]benzamide Formula: C22H16BrN7O2 MolecularWeight: 490.31214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)Br)C3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)Br)C3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

InChI

InChI=1S/C22H16BrN7O2/c1-13-11-18(25-20(31)14-7-9-15(23)10-8-14)30(28-13)22-26-19-17(21(32)27-22)12-24-29(19)16-5-3-2-4-6-16/h2-12,24H,1H3,(H,25,31)