[(1S)-1-[5-fluoranyl-2-(1-methylimidazol-2-yl)sulfanyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[5-fluoranyl-2-(1-methylimidazol-2-yl)sulfanyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanyl-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[5-fluoro-2-[(1-methyl-2-imidazolyl)thio]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]ethyl]azanium Traditional Name: [(1S)-1-[5-fluoro-2-[(1-methylimidazol-2-yl)thio]phenyl]ethyl]ammonium Formula: C12H15FN3S+ MolecularWeight: 252.331003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)F)SC2=NC=CN2C)[NH3+]

Isomeric SMILES

C[C@@H](C1=C(C=CC(=C1)F)SC2=NC=CN2C)[NH3+]

InChI

InChI=1S/C12H14FN3S/c1-8(14)10-7-9(13)3-4-11(10)17-12-15-5-6-16(12)2/h3-8H,14H2,1-2H3/p+1/t8-/m0/s1