Vitas-M small molecule compound
methyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-[4-(benzyloxy)-3-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798178
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1ccc(c(c1)OC)OCc1ccccc1)/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 C33H30N2O8S MW 614.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2O8S/c1-19-29(32(38)41-5)30(23-12-14-25(43-20(2)36)27(17-23)40-4)35-31(37)28(44-33(35)34-19)16-22-11-13-24(26(15-22)39-3)42-18-21-9-7-6-8-10-21/h6-17,30H,18H2,1-5H3/b28-16+InChIKey
RWUVGDBMEDTEOD-LQKURTRISA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)SC2=N1)C5=CC(=C(C=C5)OC(=O)C)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1ccc(c(c1)OC)OCc1ccccc1)s2
InChI=1SC33H30N2O8Sc11929(32(38)415)30(23121425(4320(2)36)27(1723)404)3531(37)28(4433(35)3419)1622111324(26(1522)393)42182197681021h61730H18H215H3b2816+
methyl(2E)5(4(acetyloxy)3methoxyphenyl)2(4(benzyloxy)3methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4acetyloxy3methoxyphenyl)2((3methoxy4phenylmethoxyphenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417581
ZINC000100838375
ZINC000100838376
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.