2-[1-oxidanylidene-3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-oxidanylidene-3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-benzyl-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[1-oxo-3-phenyl-1-[4-(2-pyrimidinyl)-1-piperazinyl]propan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-oxo-3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-benzyl-2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H23N5O3/c31-22-19-9-4-5-10-20(19)23(32)30(22)21(17-18-7-2-1-3-8-18)24(33)28-13-15-29(16-14-28)25-26-11-6-12-27-25/h1-12,21H,13-17H2