Vitas-M small molecule compound
ethyl (2E)-2-(5-bromo-2-hydroxybenzylidene)-5-(4-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL407013
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1cc(Br)ccc1O)/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 C23H18BrClN2O4S MW 533.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrClN2O4S/c1-3-31-22(30)19-12(2)26-23-27(20(19)13-4-7-16(25)8-5-13)21(29)18(32-23)11-14-10-15(24)6-9-17(14)28/h4-11,20,28H,3H2,1-2H3/b18-11+InChIKey
KIDGAZZFPGRGOA-WOJGMQOQSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1cc(Br)ccc1O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=C(C=CC(=C4)Br)O)S2)C
ethyl(2E)2((5bromo2hydroxyphenyl)methylidene)5(4chlorophenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(5bromo2hydroxybenzylidene)5(4chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC23H18BrClN2O4Sc133122(30)1912(2)262327(20(19)134716(25)8513)21(29)18(3223)11141015(24)6917(14)28h4112028H3H212H3b1811+
MFCD04083813
ZINC000006487769
ZINC000006487796
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