[(1S)-1-[2-fluoranyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-fluoranyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-fluoro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-fluoro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-fluoro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-fluoro-6-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium Formula: C13H15FN3OS+ MolecularWeight: 280.341103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=CC=CC(=C2C(C)[NH3+])F

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=CC=CC(=C2[C@H](C)[NH3+])F

InChI

InChI=1S/C13H14FN3OS/c1-7-6-11(18)17-13(16-7)19-10-5-3-4-9(14)12(10)8(2)15/h3-6,8H,15H2,1-2H3,(H,16,17,18)/p+1/t8-/m0/s1