2-[4-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]pentyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]pentyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]pentyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(5-fluoro-2-pyrimidinyl)-1-piperazinyl]pentyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]pentyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(5-fluoropyrimidin-2-yl)piperazino]pentyl]isoindoline-1,3-quinone Formula: C21H24FN5O2 MolecularWeight: 397.445963

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=NC=C(C=N4)F

Isomeric SMILES

CC(CCCN1C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=NC=C(C=N4)F

InChI

InChI=1S/C21H24FN5O2/c1-15(25-9-11-26(12-10-25)21-23-13-16(22)14-24-21)5-4-8-27-19(28)17-6-2-3-7-18(17)20(27)29/h2-3,6-7,13-15H,4-5,8-12H2,1H3