Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-2-[4-(acetyloxy)-3-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533100
SMILES CCOc1cc(ccc1OC(=O)C)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccc(c(c1)OC)OC(=O)C)/s2)C(=O)OCC
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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 C30H30N2O9S MW 594.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O9S/c1-7-38-24-15-20(10-12-22(24)41-18(5)34)27-26(29(36)39-8-2)16(3)31-30-32(27)28(35)25(42-30)14-19-9-11-21(40-17(4)33)23(13-19)37-6/h9-15,27H,7-8H2,1-6H3/b25-14+InChIKey
AAQYVUZHNARENI-AFUMVMLFSA-NSynonyms
(E)ethyl5(4acetoxy3ethoxyphenyl)2(4acetoxy3methoxybenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OC(=O)C)OC)S3)C)C(=O)OCC)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(c(c1)OC)OC(=O)C)s2)C(=O)OCC
ethyl(2E)5(4(acetyloxy)3ethoxyphenyl)2(4(acetyloxy)3methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3ethoxyphenyl)2((4acetyloxy3methoxyphenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC30H30N2O9Sc1738241520(101222(24)4118(5)34)2726(29(36)3982)16(3)313032(27)28(35)25(4230)141991121(4017(4)33)23(1319)376h91527H78H216H3b2514+
MFCD01958961
ZINC000097966429
ZINC000097966430
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.