Benzothiazolium, 3-methyl-2-(methylthio)-, 4-methylbenzenesulfonate (1:1)
CAS Registry Number®
55514-14-2
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CAS Name
Benzothiazolium, 3-methyl-2-(methylthio)-, 4-methylbenzenesulfonate (1:1)Molecular Formula
C9H10NS2.C7H7O3SCite this Page
Benzothiazolium, 3-methyl-2-(methylthio)-, 4-methylbenzenesulfonate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=55514-14-2 (retrieved ) (CAS RN: 55514-14-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C9H10NS2.C7H8O3S/c1-10-7-5-3-4-6-8(7)12-9(10)11-2;1-6-2-4-7(5-3-6)11(8,9)10/h3-6H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey
InChIKey=SGABZOJLSUJGFH-UHFFFAOYSA-M
SMILES
C[N+]=1C=2C(SC1SC)=CC=CC2.S(=O)(=O)([O-])C1=CC=C(C)C=C1
Canonical SMILES
O=S(=O)([O-])C1=CC=C(C=C1)C.S1C(SC)=[N+](C=2C=CC=CC12)C
Other Names for this Substance
- Benzothiazolium, 3-methyl-2-(methylthio)-, 4-methylbenzenesulfonate (1:1)
- Benzothiazolium, 3-methyl-2-(methylthio)-, salt with 4-methylbenzenesulfonic acid (1:1)
- 3-Methyl-2-(methylthio)benzothiazolium tosylate
- N-Methyl-2-methylthiobenzothiazolium p-toluenesulfonate
- 3-Methyl-2-(methylthio)benzothiazolium p-toluenesulfonate
