[(1S)-1-[2-[(2S)-butan-2-yl]sulfanylphenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-[(2S)-butan-2-yl]sulfanylphenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-[(1S)-1-methylpropyl]sulfanylphenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-[[(2S)-butan-2-yl]thio]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-[(2S)-butan-2-yl]sulfanylphenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-[[(1S)-1-methylpropyl]thio]phenyl]ethyl]ammonium Formula: C12H20NS+ MolecularWeight: 210.3589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NS/c1-4-9(2)14-12-8-6-5-7-11(12)10(3)13/h5-10H,4,13H2,1-3H3/p+1/t9-,10-/m0/s1