Vitas-M small molecule compound
2-{[3-cyano-4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK843375
SMILES CCOc1cc(ccc1O)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccc(cc1)F
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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 C22H20FN3O4S MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3O4S/c1-2-30-19-9-13(3-8-18(19)27)16-10-20(28)26-22(17(16)11-24)31-12-21(29)25-15-6-4-14(23)5-7-15/h3-9,16,27H,2,10,12H2,1H3,(H,25,29)(H,26,28)InChIKey
NXDFAWLXYXNSJX-UHFFFAOYSA-NSynonyms
684237-94-32((3cyano4(3ethoxy4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((3cyano4(3ethoxy4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)thio)N(4fluorophenyl)acetamide
2((5CYANO4(3ETHOXY4HYDROXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
684237943
CCOC1=C(C=CC(=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)F)O
InChI=1SC22H20FN3O4Sc123019913(3818(19)27)161020(28)2622(17(16)1124)311221(29)25156414(23)5715h391627H21012H21H3(H2529)(H2628)
MFCD03668174
ZINC000009109440
ZINC000009109441
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