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

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

Systemtic Name:5-methyl-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione
Openeye Name:5-methyl-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindoline-1,3-dione
CAS Name:5-methyl-2-[4-[4-(5-phenyl-2-pyrimidinyl)-1-piperazinyl]butyl]isoindole-1,3-dione
IUPAC Name:5-methyl-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione
Traditional Name:5-methyl-2-[4-[4-(5-phenylpyrimidin-2-yl)piperazino]butyl]isoindoline-1,3-quinone
Formula: C27H29N5O2
MolecularWeight: 455.55146
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NC=C(C=N4)C5=CC=CC=C5


Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NC=C(C=N4)C5=CC=CC=C5


InChI

InChI=1S/C27H29N5O2/c1-20-9-10-23-24(17-20)26(34)32(25(23)33)12-6-5-11-30-13-15-31(16-14-30)27-28-18-22(19-29-27)21-7-3-2-4-8-21/h2-4,7-10,17-19H,5-6,11-16H2,1H3


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