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

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-cyano-2-methyl-pyrazol-3-yl)butanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-4-(1,3-dioxo-2-benzo[de]isoquinolinyl)butanamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-4-(1,3-diketobenzo[de]isoquinolin-2-yl)butyramide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

CN1C(=C(C=N1)C#N)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C21H17N5O3/c1-25-19(14(11-22)12-23-25)24-17(27)9-4-10-26-20(28)15-7-2-5-13-6-3-8-16(18(13)15)21(26)29/h2-3,5-8,12H,4,9-10H2,1H3,(H,24,27)