N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-4-methyl-pentanamide

Systemtic Name: N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-4-methyl-pentanamide Openeye Name: N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]-4-methyl-pentanamide CAS Name: N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-4-methylpentanamide IUPAC Name: N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-4-methylpentanamide Traditional Name: N-(4-cyanophenyl)-2-[1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]-4-methyl-valeramide Formula: C29H26N4O2 MolecularWeight: 462.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)C#N)N2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)C#N)N2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C29H26N4O2/c1-18(2)15-26(28(34)32-20-13-11-19(16-30)12-14-20)33-27(22-8-3-4-9-23(22)29(33)35)24-17-31-25-10-6-5-7-21(24)25/h3-14,17-18,26-27,31H,15H2,1-2H3,(H,32,34)