Vitas-M small molecule compound
ethyl (2E)-5-(4-chlorophenyl)-2-(3,5-dibromo-4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK673881
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1cc(Br)c(c(c1)Br)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 C23H17Br2ClN2O4S MW 612.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Br2ClN2O4S/c1-3-32-22(31)18-11(2)27-23-28(19(18)13-4-6-14(26)7-5-13)21(30)17(33-23)10-12-8-15(24)20(29)16(25)9-12/h4-10,19,29H,3H2,1-2H3/b17-10+InChIKey
BMQWNPFCQMWSQL-LICLKQGHSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1cc(Br)c(c(c1)Br)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC(=C(C(=C4)Br)O)Br)S2)C
ETHYL(2E)5(4CHLOROPHENYL)2((35DIBROMO4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)5(4chlorophenyl)2(35dibromo4hydroxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(4CHLOROPHENYL)2(35DIBROMO4HYDROXYBENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H17Br2ClN2O4Sc133222(31)1811(2)272328(19(18)134614(26)7513)21(30)17(3323)1012815(24)20(29)16(25)912h4101929H3H212H3b1710+
MFCD01155578
ZINC000008443361
ZINC000008443362
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Check stock on Vitas-MAvailable files
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