N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-1,3-bis(oxidanylidene)-2-propan-2-yl-isoindole-5-carboxamide

Systemtic Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-1,3-bis(oxidanylidene)-2-propan-2-yl-isoindole-5-carboxamide Openeye Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-2-isopropyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]-1,3-dioxo-2-propan-2-yl-5-isoindolecarboxamide IUPAC Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-1,3-dioxo-2-propan-2-ylisoindole-5-carboxamide Traditional Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-2-isopropyl-1,3-diketo-isoindoline-5-carboxamide Formula: C26H20N6O3 MolecularWeight: 464.4754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C(C)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C(C)C

InChI

InChI=1S/C26H20N6O3/c1-14(2)31-25(34)19-9-8-16(11-20(19)26(31)35)24(33)30-23-17(12-27)13-28-32(23)22-10-15(3)18-6-4-5-7-21(18)29-22/h4-11,13-14H,1-3H3,(H,30,33)