1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C18H21FN4O MolecularWeight: 328.383943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=CC=N3

InChI

InChI=1S/C18H21FN4O/c19-16-6-4-15(5-7-16)17(24)3-1-10-22-11-13-23(14-12-22)18-20-8-2-9-21-18/h2,4-9H,1,3,10-14H2