Vitas-M small molecule compound
ethyl 5-cyano-4-(2-ethoxyphenyl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK826194
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1OCC)C#N)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 C20H22N2O6S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6S/c1-4-27-14-9-7-6-8-12(14)16-13(10-21)19(29-11-15(23)26-3)22-18(24)17(16)20(25)28-5-2/h6-9,16-17H,4-5,11H2,1-3H3,(H,22,24)InChIKey
FBTWOHXQCWBDAA-UHFFFAOYSA-NSynonyms
361166-85-0361166850
CCOC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)OC)C(=O)OCC
ethyl5cyano4(2ethoxyphenyl)6((2methoxy2oxoethyl)sulfanyl)2oxo1234tetrahydropyridine3carboxylate
ethyl5cyano4(2ethoxyphenyl)6((2methoxy2oxoethyl)thio)2oxo1234tetrahydropyridine3carboxylate
ETHYL5CYANO4(2ETHOXYPHENYL)6(2METHOXY2OXOETHYL)SULFANYL2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC20H22N2O6Sc142714976812(14)1613(1021)19(291115(23)263)2218(24)17(16)20(25)2852h691617H4511H213H3(H2224)
MFCD03293496
ZINC000001240214
ZINC000001240217
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