2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)ethanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]acetamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]acetamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)acetamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]acetamide Formula: C23H13BrN6O3 MolecularWeight: 501.29172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)CN4C(=O)C5=C(C4=O)C=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)CN4C(=O)C5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C23H13BrN6O3/c24-15-6-7-16-17(9-15)23(33)29(22(16)32)12-20(31)28-21-14(10-25)11-26-30(21)19-8-5-13-3-1-2-4-18(13)27-19/h1-9,11H,12H2,(H,28,31)