[(2S)-1-(1,3-benzothiazol-2-yl)hexan-2-yl]azanium

Systemtic Name: [(2S)-1-(1,3-benzothiazol-2-yl)hexan-2-yl]azanium Openeye Name: [(1S)-1-(1,3-benzothiazol-2-ylmethyl)pentyl]ammonium CAS Name: [(2S)-1-(1,3-benzothiazol-2-yl)hexan-2-yl]ammonium IUPAC Name: [(2S)-1-(1,3-benzothiazol-2-yl)hexan-2-yl]azanium Traditional Name: [(1S)-1-(1,3-benzothiazol-2-ylmethyl)pentyl]ammonium Formula: C13H19N2S+ MolecularWeight: 235.36836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=NC2=CC=CC=C2S1)[NH3+]

Isomeric SMILES

CCCC[C@@H](CC1=NC2=CC=CC=C2S1)[NH3+]

InChI

InChI=1S/C13H18N2S/c1-2-3-6-10(14)9-13-15-11-7-4-5-8-12(11)16-13/h4-5,7-8,10H,2-3,6,9,14H2,1H3/p+1/t10-/m0/s1