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

Systemtic Name: 3-(1-methyl-2-phenyl-indol-3-yl)-2-[1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-methyl-2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one CAS Name: 3-(1-methyl-2-phenyl-3-indolyl)-2-[1-oxo-1-[4-(2-pyridinyl)-1-piperazinyl]propan-2-yl]-3H-isoindol-1-one IUPAC Name: 3-(1-methyl-2-phenylindol-3-yl)-2-[1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[2-keto-1-methyl-2-[4-(2-pyridyl)piperazino]ethyl]-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-1-one Formula: C35H33N5O2 MolecularWeight: 555.66882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=N2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=N2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

InChI

InChI=1S/C35H33N5O2/c1-24(34(41)39-22-20-38(21-23-39)30-18-10-11-19-36-30)40-33(26-14-6-7-15-27(26)35(40)42)31-28-16-8-9-17-29(28)37(2)32(31)25-12-4-3-5-13-25/h3-19,24,33H,20-23H2,1-2H3