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

Systemtic Name: [(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-(3-methylsulfanylpropyl)azanium Openeye Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-(3-methylsulfanylpropyl)ammonium CAS Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidinyl]-[3-(methylthio)propyl]ammonium IUPAC Name: [(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-(3-methylsulfanylpropyl)azanium Traditional Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-[3-(methylthio)propyl]ammonium Formula: C16H24N3S2+ MolecularWeight: 322.51186

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH2+]C1CCCN(C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CSCCC[NH2+][C@H]1CCCN(C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H23N3S2/c1-20-11-5-9-17-13-6-4-10-19(12-13)16-18-14-7-2-3-8-15(14)21-16/h2-3,7-8,13,17H,4-6,9-12H2,1H3/p+1/t13-/m0/s1