2-bromanyl-N'-[3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoyl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoyl]benzohydrazide Openeye Name: 2-bromo-N'-[3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoyl]benzohydrazide CAS Name: 2-bromo-N'-[1-oxo-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propyl]benzohydrazide IUPAC Name: 2-bromo-N'-[3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoyl]benzohydrazide Traditional Name: 2-bromo-N'-[3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoyl]benzohydrazide Formula: C21H17BrN6O3 MolecularWeight: 481.30208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CCC(=O)NNC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CCC(=O)NNC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C21H17BrN6O3/c22-16-9-5-4-8-14(16)21(31)27-26-18(29)11-10-17-24-19-15(20(30)25-17)12-23-28(19)13-6-2-1-3-7-13/h1-9,12,23H,10-11H2,(H,26,29)(H,27,31)