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

Systemtic Name: 3-methyl-2-[1-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3-oxidanylidene-1H-isoindol-2-yl]-N-(4-pyrrolidin-1-ylphenyl)pentanamide Openeye Name: 3-methyl-2-[1-[1-methyl-2-(p-tolyl)indol-3-yl]-3-oxo-isoindolin-2-yl]-N-(4-pyrrolidin-1-ylphenyl)pentanamide CAS Name: 3-methyl-2-[1-[1-methyl-2-(4-methylphenyl)-3-indolyl]-3-oxo-1H-isoindol-2-yl]-N-[4-(1-pyrrolidinyl)phenyl]pentanamide IUPAC Name: 3-methyl-2-[1-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3-oxo-1H-isoindol-2-yl]-N-(4-pyrrolidin-1-ylphenyl)pentanamide Traditional Name: 2-[1-keto-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-2-yl]-3-methyl-N-(4-pyrrolidinophenyl)valeramide Formula: C40H42N4O2 MolecularWeight: 610.78708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCC2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=C(C=C7)C

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCC2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=C(C=C7)C

InChI

InChI=1S/C40H42N4O2/c1-5-27(3)36(39(45)41-29-20-22-30(23-21-29)43-24-10-11-25-43)44-38(31-12-6-7-13-32(31)40(44)46)35-33-14-8-9-15-34(33)42(4)37(35)28-18-16-26(2)17-19-28/h6-9,12-23,27,36,38H,5,10-11,24-25H2,1-4H3,(H,41,45)