[(2S)-3-methylbutan-2-yl]-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium

Systemtic Name: [(2S)-3-methylbutan-2-yl]-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ammonium CAS Name: [(2S)-3-methylbutan-2-yl]-[[4-(trifluoromethylthio)phenyl]methyl]ammonium IUPAC Name: [(2S)-3-methylbutan-2-yl]-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-[4-(trifluoromethylthio)benzyl]ammonium Formula: C13H19F3NS+ MolecularWeight: 278.35687

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)[NH2+]CC1=CC=C(C=C1)SC(F)(F)F

Isomeric SMILES

C[C@@H](C(C)C)[NH2+]CC1=CC=C(C=C1)SC(F)(F)F

InChI

InChI=1S/C13H18F3NS/c1-9(2)10(3)17-8-11-4-6-12(7-5-11)18-13(14,15)16/h4-7,9-10,17H,8H2,1-3H3/p+1/t10-/m0/s1