Vitas-M small molecule compound
1-(5-formyl-3-methyl-2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-3,5-dimethylpyridinium
Catalog ID
STL059027
SMILES O=Cc1sc(=O)n(c1[n+]1cc(C)cc(c1)C)C
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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 C12H13N2O2S MW 249.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N2O2S/c1-8-4-9(2)6-14(5-8)11-10(7-15)17-12(16)13(11)3/h4-7H,1-3H3/q+1InChIKey
GSEVIEPEXGSXLD-UHFFFAOYSA-NSynonyms
1(5formyl3methyl2oxo23dihydro13thiazol4yl)35dimethylpyridinium
1(5formyl3methyl2oxo23dihydrothiazol4yl)35dimethylpyridin1iumiodide
4(35DIMETHYLPYRIDIN1IUM1YL)3METHYL2OXO13THIAZOLE5CARBALDEHYDE
CC1=CC(=C(N+)(=C1)C2=C(SC(=O)N2C)C=O)C
InChI=1SC12H13N2O2Sc1849(2)614(58)1110(715)1712(16)13(11)3h47H13H3q+1
O=Cc1sc(=O)n(c1(n+)1cc(C)cc(c1)C)C
O=Cc1sc(=O)n(c1(n+)1cc(C)cc(c1)C)C(I)
ZINC000000495257
ZINC00495257
ZINC495257
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