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4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione

4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name:4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione
Openeye Name:4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindoline-1,3-dione
CAS Name:4-methoxy-2-[4-[4-(5-phenyl-2-pyrimidinyl)-1-piperazinyl]butyl]isoindole-1,3-dione
IUPAC Name:4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione
Traditional Name:4-methoxy-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazino]butyl]isoindoline-1,3-quinone
Formula: C27H29N5O3
MolecularWeight: 471.55086
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NC=C(C=N4)C5=CC=CC=C5


Isomeric SMILES

COC1=CC=CC2=C1C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NC=C(C=N4)C5=CC=CC=C5


InChI

InChI=1S/C27H29N5O3/c1-35-23-11-7-10-22-24(23)26(34)32(25(22)33)13-6-5-12-30-14-16-31(17-15-30)27-28-18-21(19-29-27)20-8-3-2-4-9-20/h2-4,7-11,18-19H,5-6,12-17H2,1H3


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