Vitas-M small molecule compound
(5E)-5-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-ethoxybenzylidene}-3-[2-(morpholin-4-yl)-2-oxoethyl]-1,3-thiazolidine-2,4-dione
Catalog ID
STK320456
SMILES CCOc1cc(ccc1Oc1nc(Cl)ncc1F)/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCOCC1
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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 C22H20ClFN4O6S MW 522.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClFN4O6S/c1-2-33-16-9-13(3-4-15(16)34-19-14(24)11-25-21(23)26-19)10-17-20(30)28(22(31)35-17)12-18(29)27-5-7-32-8-6-27/h3-4,9-11H,2,5-8,12H2,1H3/b17-10+InChIKey
BKWJKKQBLWZMSW-LICLKQGHSA-NSynonyms
(5E)5((4(2chloro5fluoropyrimidin4yl)oxy3ethoxyphenyl)methylidene)3(2morpholin4yl2oxoethyl)13thiazolidine24dione
(5E)5(4((2chloro5fluoropyrimidin4yl)oxy)3ethoxybenzylidene)3(2(morpholin4yl)2oxoethyl)13thiazolidine24dione
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCOCC3)OC4=NC(=NC=C4F)Cl
CCOc1cc(ccc1Oc1nc(Cl)ncc1F)C=C1SC(=O)N(C1=O)CC(=O)N1CCOCC1
InChI=1SC22H20ClFN4O6Sc123316913(3415(16)341914(24)112521(23)2619)101720(30)28(22(31)3517)1218(29)2757328627h34911H25812H21H3b1710+
MFCD09961536
ZINC000097962226
ZINC97962226
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