Vitas-M small molecule compound
ethyl 5-cyano-2-hydroxy-6-[(2-methoxy-2-oxoethyl)sulfanyl]pyridine-3-carboxylate
Catalog ID
STK064575
SMILES CCOC(=O)c1cc(C#N)c(nc1O)SCC(=O)OC
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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 C12H12N2O5S MW 296.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O5S/c1-3-19-12(17)8-4-7(5-13)11(14-10(8)16)20-6-9(15)18-2/h4H,3,6H2,1-2H3,(H,14,16)InChIKey
LEDHHQMMRSDBEH-UHFFFAOYSA-NSynonyms
380328-00-7380328007
5CYANO2HYDROXY6METHOXYCARBONYLMETHYLSULFANYLNICOTINICACIDETHYLESTER
CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)OC)C#N
CCOC(=O)c1cc(C#N)c(nc1O)SCC(=O)OC
ETHYL5CYANO2HYDROXY6((2METHOXY2OXOETHYL)SULFANYL)NICOTINATE
ETHYL5CYANO2HYDROXY6((2METHOXY2OXOETHYL)SULFANYL)PYRIDINE3CARBOXYLATE
ETHYL5CYANO6(2METHOXY2OXOETHYL)SULFANYL2OXO1HPYRIDINE3CARBOXYLATE
InChI=1SC12H12N2O5Sc131912(17)847(513)11(1410(8)16)2069(15)182h4H36H212H3(H1416)
MFCD03032133
STK064575
ZINC000004640863
ZINC4640863
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