Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK534192
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C\c1ccc(cc1)C(C)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 C30H32N2O6S MW 548.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O6S/c1-7-36-24-16-22(13-14-23(24)38-19(6)33)27-26(29(35)37-8-2)18(5)31-30-32(27)28(34)25(39-30)15-20-9-11-21(12-10-20)17(3)4/h9-17,27H,7-8H2,1-6H3/b25-15+InChIKey
NIVSTMMZGOVTTC-MFKUBSTISA-NSynonyms
373374-21-1(E)ethyl5(4acetoxy3ethoxyphenyl)2(4isopropylbenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
373374211
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)c(=Cc1ccc(cc1)C(C)C)s2
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=C(C=C4)C(C)C)S3)C)C(=O)OCC)OC(=O)C
ethyl(2E)5(4(acetyloxy)3ethoxyphenyl)7methyl3oxo2(4(propan2yl)benzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3ethoxyphenyl)7methyl3oxo2((4propan2ylphenyl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC30H32N2O6Sc1736241622(131423(24)3819(6)33)2726(29(35)3782)18(5)313032(27)28(34)25(3930)152091121(121020)17(3)4h91727H78H216H3b2515+
MFCD01946292
ZINC000100715200
ZINC000100715202
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.