2-[3-methyl-1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]-3-[2-(4-methylphenyl)-1H-indol-3-yl]-3H-isoindol-1-one

Systemtic Name: 2-[3-methyl-1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]-3-[2-(4-methylphenyl)-1H-indol-3-yl]-3H-isoindol-1-one Openeye Name: 2-[2-methyl-1-[4-(2-pyridyl)piperazine-1-carbonyl]butyl]-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-1-one CAS Name: 2-[3-methyl-1-oxo-1-[4-(2-pyridinyl)-1-piperazinyl]pentan-2-yl]-3-[2-(4-methylphenyl)-1H-indol-3-yl]-3H-isoindol-1-one IUPAC Name: 2-[3-methyl-1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)pentan-2-yl]-3-[2-(4-methylphenyl)-1H-indol-3-yl]-3H-isoindol-1-one Traditional Name: 2-[2-methyl-1-[4-(2-pyridyl)piperazine-1-carbonyl]butyl]-3-[2-(p-tolyl)-1H-indol-3-yl]isoindolin-1-one Formula: C38H39N5O2 MolecularWeight: 597.74856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=N2)N3C(C4=CC=CC=C4C3=O)C5=C(NC6=CC=CC=C65)C7=CC=C(C=C7)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=N2)N3C(C4=CC=CC=C4C3=O)C5=C(NC6=CC=CC=C65)C7=CC=C(C=C7)C

InChI

InChI=1S/C38H39N5O2/c1-4-26(3)35(38(45)42-23-21-41(22-24-42)32-15-9-10-20-39-32)43-36(28-11-5-6-12-29(28)37(43)44)33-30-13-7-8-14-31(30)40-34(33)27-18-16-25(2)17-19-27/h5-20,26,35-36,40H,4,21-24H2,1-3H3