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

Systemtic Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]-2-cyclohexyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-2-cyclohexyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-2-cyclohexyl-1,3-diketo-isoindoline-5-carboxamide Formula: C29H24N6O3 MolecularWeight: 504.53926

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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)C6CCCCC6

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)C6CCCCC6

InChI

InChI=1S/C29H24N6O3/c1-17-13-25(32-24-10-6-5-9-21(17)24)35-26(19(15-30)16-31-35)33-27(36)18-11-12-22-23(14-18)29(38)34(28(22)37)20-7-3-2-4-8-20/h5-6,9-14,16,20H,2-4,7-8H2,1H3,(H,33,36)