Vitas-M small molecule compound

ethyl (2E)-2-[3-(acetyloxy)-4-methoxybenzylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK726553
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C\c1ccc(c(c1)OC(=O)C)OC)/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 C26H23ClN2O6S MW 527.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O6S/c1-5-34-25(32)22-14(2)28-26-29(23(22)17-8-6-7-9-18(17)27)24(31)21(36-26)13-16-10-11-19(33-4)20(12-16)35-15(3)30/h6-13,23H,5H2,1-4H3/b21-13+
InChIKey
MWUAUVGVBBFHFC-FYJGNVAPSA-N
Synonyms
313381-31-6
(E)ethyl2(3acetoxy4methoxybenzylidene)5(2chlorophenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
313381316
5((5(2CHLOROPHENYL)6(ETHOXYCARBONYL)7METHYL3OXO(45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN2YLIDENE))METHYL)2METHOXYPHENYLACETATE
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1ccc(c(c1)OC(=O)C)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=CC(=C(C=C4)OC)OC(=O)C)S2)C
ethyl(2E)2((3acetyloxy4methoxyphenyl)methylidene)5(2chlorophenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(3(acetyloxy)4methoxybenzylidene)5(2chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H23ClN2O6Sc153425(32)2214(2)282629(23(22)17867918(17)27)24(31)21(3626)1316101119(334)20(1216)3515(3)30h61323H5H214H3b2113+
MFCD01458309
ZINC000059844508
ZINC000059844511

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Available files

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