Vitas-M small molecule compound
ethyl (2E)-2-[2-(acetyloxy)-5-bromobenzylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK726627
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C\c1cc(Br)ccc1OC(=O)C)/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 C25H20BrClN2O5S MW 575.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrClN2O5S/c1-4-33-24(32)21-13(2)28-25-29(22(21)17-7-5-6-8-18(17)27)23(31)20(35-25)12-15-11-16(26)9-10-19(15)34-14(3)30/h5-12,22H,4H2,1-3H3/b20-12+InChIKey
LTDCRVHWGZPZSD-UDWIEESQSA-NSynonyms
(E)ethyl2(2acetoxy5bromobenzylidene)5(2chlorophenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1cc(Br)ccc1OC(=O)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=C(C=CC(=C4)Br)OC(=O)C)S2)C
ethyl(2E)2((2acetyloxy5bromophenyl)methylidene)5(2chlorophenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(2(acetyloxy)5bromobenzylidene)5(2chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(2ACETOXY5BROMOBENZYLIDENE)5(2CHLOROPHENYL)7METHYL3OXO35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H20BrClN2O5Sc143324(32)2113(2)282529(22(21)17756818(17)27)23(31)20(3525)12151116(26)91019(15)3414(3)30h51222H4H213H3b2012+
MFCD01794201
ZINC000100598935
ZINC000100598940
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Check stock on Vitas-MAvailable files
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