4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(2-phenylpyrimidin-5-yl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(2-phenylpyrimidin-5-yl)butanamide Openeye Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(2-phenylpyrimidin-5-yl)butanamide CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(2-phenyl-5-pyrimidinyl)butanamide IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(2-phenylpyrimidin-5-yl)butanamide Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(2-phenylpyrimidin-5-yl)butyramide Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

InChI

InChI=1S/C26H20N4O3/c31-22(29-19-15-27-24(28-16-19)18-7-2-1-3-8-18)13-6-14-30-25(32)20-11-4-9-17-10-5-12-21(23(17)20)26(30)33/h1-5,7-12,15-16H,6,13-14H2,(H,29,31)