1-[4-[6-(2-fluoranylphenoxy)pyrimidin-4-yl]-2-methyl-piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[6-(2-fluoranylphenoxy)pyrimidin-4-yl]-2-methyl-piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[6-(2-fluorophenoxy)pyrimidin-4-yl]-2-methyl-piperazin-1-yl]propan-1-one CAS Name: 1-[4-[6-(2-fluorophenoxy)-4-pyrimidinyl]-2-methyl-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[6-(2-fluorophenoxy)pyrimidin-4-yl]-2-methylpiperazin-1-yl]propan-1-one Traditional Name: 1-[4-[6-(2-fluorophenoxy)pyrimidin-4-yl]-2-methyl-piperazino]propan-1-one Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1C)C2=CC(=NC=N2)OC3=CC=CC=C3F

Isomeric SMILES

CCC(=O)N1CCN(CC1C)C2=CC(=NC=N2)OC3=CC=CC=C3F

InChI

InChI=1S/C18H21FN4O2/c1-3-18(24)23-9-8-22(11-13(23)2)16-10-17(21-12-20-16)25-15-7-5-4-6-14(15)19/h4-7,10,12-13H,3,8-9,11H2,1-2H3