N-[4-(3,5-dimethylpiperidin-1-yl)phenyl]-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)phenyl]-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanamide Openeye Name: N-[4-(3,5-dimethyl-1-piperidyl)phenyl]-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanamide CAS Name: N-[4-(3,5-dimethyl-1-piperidinyl)phenyl]-3-methyl-2-[1-(1-methyl-2-phenyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]pentanamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)phenyl]-3-methyl-2-[1-(1-methyl-2-phenylindol-3-yl)-3-oxo-1H-isoindol-2-yl]pentanamide Traditional Name: N-[4-(3,5-dimethylpiperidino)phenyl]-2-[1-keto-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-2-yl]-3-methyl-valeramide Formula: C42H46N4O2 MolecularWeight: 638.84024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)N2CC(CC(C2)C)C)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=C(C=C1)N2CC(CC(C2)C)C)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

InChI

InChI=1S/C42H46N4O2/c1-6-29(4)38(41(47)43-31-20-22-32(23-21-31)45-25-27(2)24-28(3)26-45)46-40(33-16-10-11-17-34(33)42(46)48)37-35-18-12-13-19-36(35)44(5)39(37)30-14-8-7-9-15-30/h7-23,27-29,38,40H,6,24-26H2,1-5H3,(H,43,47)