2-[[3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzyl]isoindoline-1,3-quinone Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H21N5O3/c30-21(27-11-13-28(14-12-27)24-25-9-4-10-26-24)18-6-3-5-17(15-18)16-29-22(31)19-7-1-2-8-20(19)23(29)32/h1-10,15H,11-14,16H2