5-fluoranyl-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]-1H-pyrimidin-6-one

Systemtic Name: 5-fluoranyl-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]-1H-pyrimidin-6-one Openeye Name: 5-fluoro-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]-1H-pyrimidin-6-one CAS Name: 5-fluoro-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-piperazinyl]-1H-pyrimidin-6-one IUPAC Name: 5-fluoro-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]-1H-pyrimidin-6-one Traditional Name: 5-fluoro-2-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazino]-1H-pyrimidin-6-one Formula: C13H18FN6O+ MolecularWeight: 293.320023

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CN2CCN(CC2)C3=NC=C(C(=O)N3)F

Isomeric SMILES

C[N+]1=C(NC=C1)CN2CCN(CC2)C3=NC=C(C(=O)N3)F

InChI

InChI=1S/C13H17FN6O/c1-18-3-2-15-11(18)9-19-4-6-20(7-5-19)13-16-8-10(14)12(21)17-13/h2-3,8H,4-7,9H2,1H3,(H,16,17,21)/p+1