[(1S)-1-[4-[(2S)-butan-2-yl]sulfanyl-3-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-[(2S)-butan-2-yl]sulfanyl-3-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[3-fluoro-4-[(1S)-1-methylpropyl]sulfanyl-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-[[(2S)-butan-2-yl]thio]-3-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-[(2S)-butan-2-yl]sulfanyl-3-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[3-fluoro-4-[[(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=C(C=C(C=C1)C(C)[NH3+])F

Isomeric SMILES

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

InChI

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