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

Systemtic Name: N-(4-cyanophenyl)-4-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanamide Openeye Name: N-(4-cyanophenyl)-4-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanamide CAS Name: N-(4-cyanophenyl)-4-methyl-2-[1-(1-methyl-2-phenyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]pentanamide IUPAC Name: N-(4-cyanophenyl)-4-methyl-2-[1-(1-methyl-2-phenylindol-3-yl)-3-oxo-1H-isoindol-2-yl]pentanamide Traditional Name: N-(4-cyanophenyl)-2-[1-keto-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-2-yl]-4-methyl-valeramide Formula: C36H32N4O2 MolecularWeight: 552.66488

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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=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)C#N)N2C(C3=CC=CC=C3C2=O)C4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6

InChI

InChI=1S/C36H32N4O2/c1-23(2)21-31(35(41)38-26-19-17-24(22-37)18-20-26)40-34(27-13-7-8-14-28(27)36(40)42)32-29-15-9-10-16-30(29)39(3)33(32)25-11-5-4-6-12-25/h4-20,23,31,34H,21H2,1-3H3,(H,38,41)