N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-(2-methoxyethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-2-(2-methoxyethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-(2-methoxyethyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-(2-methoxyethyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-1,3-diketo-2-(2-methoxyethyl)isoindoline-5-carboxamide Formula: C25H18N6O4 MolecularWeight: 466.44822

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C25H18N6O4/c1-35-11-10-30-24(33)18-8-6-16(12-19(18)25(30)34)23(32)29-22-17(13-26)14-27-31(22)21-9-7-15-4-2-3-5-20(15)28-21/h2-9,12,14H,10-11H2,1H3,(H,29,32)