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

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-methyl-2-[3-oxidanylidene-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]pentanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-4-methyl-2-[1-oxo-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]pentanamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-methyl-2-[3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]pentanamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-methyl-2-[3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]pentanamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[1-keto-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]-4-methyl-valeramide Formula: C40H45N3O2 MolecularWeight: 599.8042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C12CC3CC(C1)CC(C3)C2)N4C(C5=CC=CC=C5C4=O)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C12CC3CC(C1)CC(C3)C2)N4C(C5=CC=CC=C5C4=O)C6=C(NC7=CC=CC=C76)C8=CC=CC=C8

InChI

InChI=1S/C40H45N3O2/c1-24(2)17-34(38(44)41-25(3)40-21-26-18-27(22-40)20-28(19-26)23-40)43-37(30-13-7-8-14-31(30)39(43)45)35-32-15-9-10-16-33(32)42-36(35)29-11-5-4-6-12-29/h4-16,24-28,34,37,42H,17-23H2,1-3H3,(H,41,44)