1-[4-[6-(2-fluoranyl-5-methyl-phenoxy)pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[6-(2-fluoranyl-5-methyl-phenoxy)pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[6-(2-fluoro-5-methyl-phenoxy)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[6-(2-fluoro-5-methylphenoxy)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[6-(2-fluoro-5-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[6-(2-fluoro-5-methyl-phenoxy)pyrimidin-4-yl]piperazino]propan-1-one Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC(=NC=N2)OC3=C(C=CC(=C3)C)F

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC(=NC=N2)OC3=C(C=CC(=C3)C)F

InChI

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