[(1S)-1-[2-fluoranyl-6-(2-methylpropylsulfanyl)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-fluoranyl-6-(2-methylpropylsulfanyl)phenyl]ethyl]azanium Openeye Name: [(1S)-1-(2-fluoro-6-isobutylsulfanyl-phenyl)ethyl]ammonium CAS Name: [(1S)-1-[2-fluoro-6-(2-methylpropylthio)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-fluoro-6-(2-methylpropylsulfanyl)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-fluoro-6-(isobutylthio)phenyl]ethyl]ammonium Formula: C12H19FNS+ MolecularWeight: 228.349363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=CC=CC(=C1C(C)[NH3+])F

Isomeric SMILES

C[C@@H](C1=C(C=CC=C1SCC(C)C)F)[NH3+]

InChI

InChI=1S/C12H18FNS/c1-8(2)7-15-11-6-4-5-10(13)12(11)9(3)14/h4-6,8-9H,7,14H2,1-3H3/p+1/t9-/m0/s1