2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-4-methyl-pentanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-4-methyl-pentanamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-(1,3-dioxo-2-isoindolyl)-4-methylpentanamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-(1,3-dioxoisoindol-2-yl)-4-methylpentanamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-4-methyl-2-phthalimido-valeramide Formula: C27H22N6O3 MolecularWeight: 478.50198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)CC(C(=O)NC1=C(C=NN1C2=NC3=CC=CC=C3C=C2)C#N)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H22N6O3/c1-16(2)13-22(32-26(35)19-8-4-5-9-20(19)27(32)36)25(34)31-24-18(14-28)15-29-33(24)23-12-11-17-7-3-6-10-21(17)30-23/h3-12,15-16,22H,13H2,1-2H3,(H,31,34)