Vitas-M small molecule compound

2,3-dimethyl-1,3-benzothiazol-3-ium

Catalog ID
STK396591
SMILES C[n+]1c(C)sc2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C9H10NS MW 164.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10NS/c1-7-10(2)8-5-3-4-6-9(8)11-7/h3-6H,1-2H3/q+1
InChIKey
QBQDROYKEQDPRX-UHFFFAOYSA-N
Synonyms
40265-71-2
23dimethyl13benzothiazol3ium
23DIMETHYLBENZOTHIAZOL3IUM
23DIMETHYLBENZOTHIAZOLE
23DIMETHYLBENZOTHIAZOLIUM
40265712
BENZOTHIAZOLIUM23DIMETHYL
C(n+)1c(C)sc2c1cccc2
CC1=(N+)(C2=CC=CC=C2S1)C
InChI=1SC9H10NSc1710(2)853469(8)117h36H12H3q+1
MFCD00804705
ZINC00101129
ZINC101129

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.