Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-1-methylpyridinium

Catalog ID
STL444449
SMILES C[n+]1cccc(c1)c1nc2c(s1)cccc2

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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 C13H11N2S MW 227.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N2S/c1-15-8-4-5-10(9-15)13-14-11-6-2-3-7-12(11)16-13/h2-9H,1H3/q+1
InChIKey
WBRICKSAKWNXTE-UHFFFAOYSA-N
Synonyms

2(1methylpyridin1ium3yl)13benzothiazole
3(13benzothiazol2yl)1methylpyridinium
C(N+)1=CC=CC(=C1)C2=NC3=CC=CC=C3S2
C(n+)1cccc(c1)c1nc2c(s1)cccc2
InChI=1SC13H11N2Sc11584510(915)131411623712(11)1613h29H1H3q+1
ZINC000226774240
ZINC226774240

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Available files

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