[(1S)-1-[5-fluoranyl-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[5-fluoranyl-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[5-fluoro-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[5-fluoro-2-[(6-oxo-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5-fluoro-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[5-fluoro-2-[(6-keto-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium Formula: C12H13FN3OS+ MolecularWeight: 266.314523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)F)SC2=NC=CC(=O)N2)[NH3+]

Isomeric SMILES

C[C@@H](C1=C(C=CC(=C1)F)SC2=NC=CC(=O)N2)[NH3+]

InChI

InChI=1S/C12H12FN3OS/c1-7(14)9-6-8(13)2-3-10(9)18-12-15-5-4-11(17)16-12/h2-7H,14H2,1H3,(H,15,16,17)/p+1/t7-/m0/s1