2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)propanamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-(1,3-dioxo-2-benzo[de]isoquinolinyl)propanamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-(1,3-diketobenzo[de]isoquinolin-2-yl)propionamide Formula: C28H18N6O3 MolecularWeight: 486.48092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)N4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric SMILES

CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)N4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

InChI

InChI=1S/C28H18N6O3/c1-16(33-27(36)20-9-4-7-18-8-5-10-21(24(18)20)28(33)37)26(35)32-25-19(14-29)15-30-34(25)23-13-12-17-6-2-3-11-22(17)31-23/h2-13,15-16H,1H3,(H,32,35)