[(1S)-1-[2-[(2S)-butan-2-yl]sulfanyl-6-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-[(2S)-butan-2-yl]sulfanyl-6-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-fluoro-6-[(1S)-1-methylpropyl]sulfanyl-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-[[(2S)-butan-2-yl]thio]-6-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-[(2S)-butan-2-yl]sulfanyl-6-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-fluoro-6-[[(1S)-1-methylpropyl]thio]phenyl]ethyl]ammonium Formula: C12H19FNS+ MolecularWeight: 228.349363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=CC(=C1C(C)[NH3+])F

Isomeric SMILES

CC[C@H](C)SC1=CC=CC(=C1[C@H](C)[NH3+])F

InChI

InChI=1S/C12H18FNS/c1-4-8(2)15-11-7-5-6-10(13)12(11)9(3)14/h5-9H,4,14H2,1-3H3/p+1/t8-,9-/m0/s1