[(1S)-1-[4-(2,5-dimethylphenyl)sulfanyl-3-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(2,5-dimethylphenyl)sulfanyl-3-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(2,5-dimethylphenyl)sulfanyl-3-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-[(2,5-dimethylphenyl)thio]-3-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(2,5-dimethylphenyl)sulfanyl-3-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-[(2,5-dimethylphenyl)thio]-3-fluoro-phenyl]ethyl]ammonium Formula: C16H19FNS+ MolecularWeight: 276.392163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)C(C)[NH3+])F

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)[C@H](C)[NH3+])F

InChI

InChI=1S/C16H18FNS/c1-10-4-5-11(2)16(8-10)19-15-7-6-13(12(3)18)9-14(15)17/h4-9,12H,18H2,1-3H3/p+1/t12-/m0/s1