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

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)butanamide Openeye Name: 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]butanamide CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]butanamide IUPAC Name: 4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)butanamide Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]butyramide Formula: C25H17BrN6O3 MolecularWeight: 529.34488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)CCCN4C(=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)CCCN4C(=O)C5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C25H17BrN6O3/c26-17-8-9-18-19(12-17)25(35)31(24(18)34)11-3-6-22(33)30-23-16(13-27)14-28-32(23)21-10-7-15-4-1-2-5-20(15)29-21/h1-2,4-5,7-10,12,14H,3,6,11H2,(H,30,33)