Vitas-M small molecule compound
ethyl (2Z)-5-(2-bromo-4,5-dimethoxyphenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522665
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)c(cc1Br)OC)c(=O)/c(=C/c1ccc(cc1)O)/s2
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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 C25H23BrN2O6S MW 559.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN2O6S/c1-5-34-24(31)21-13(2)27-25-28(22(21)16-11-18(32-3)19(33-4)12-17(16)26)23(30)20(35-25)10-14-6-8-15(29)9-7-14/h6-12,22,29H,5H2,1-4H3/b20-10-InChIKey
FOYKNLAJPADWLF-JMIUGGIZSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)c(cc1Br)OC)c(=O)c(=Cc1ccc(cc1)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3Br)OC)OC)C(=O)C(=CC4=CC=C(C=C4)O)S2)C
ETHYL(2Z)5(2BROMO45DIMETHOXYPHENYL)2((4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(2bromo45dimethoxyphenyl)2(4hydroxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23BrN2O6Sc153424(31)2113(2)272528(22(21)161118(323)19(334)1217(16)26)23(30)20(3525)10146815(29)9714h6122229H5H214H3b2010
MFCD02197555
ZINC000001062303
ZINC000001062308
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