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2-(1,3-benzothiazol-2-yl)ethyl-(3-methylsulfanylpropyl)azanium

2-(1,3-benzothiazol-2-yl)ethyl-(3-methylsulfanylpropyl)azanium

Systemtic Name:2-(1,3-benzothiazol-2-yl)ethyl-(3-methylsulfanylpropyl)azanium
Openeye Name:2-(1,3-benzothiazol-2-yl)ethyl-(3-methylsulfanylpropyl)ammonium
CAS Name:2-(1,3-benzothiazol-2-yl)ethyl-[3-(methylthio)propyl]ammonium
IUPAC Name:2-(1,3-benzothiazol-2-yl)ethyl-(3-methylsulfanylpropyl)azanium
Traditional Name:2-(1,3-benzothiazol-2-yl)ethyl-[3-(methylthio)propyl]ammonium
Formula: C13H19N2S2+
MolecularWeight: 267.43336
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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH2+]CCC1=NC2=CC=CC=C2S1


Isomeric SMILES

CSCCC[NH2+]CCC1=NC2=CC=CC=C2S1


InChI

InChI=1S/C13H18N2S2/c1-16-10-4-8-14-9-7-13-15-11-5-2-3-6-12(11)17-13/h2-3,5-6,14H,4,7-10H2,1H3/p+1


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