Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-2-(3,4-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533720
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C\c1ccc(c(c1)OC)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 C29H30N2O8S MW 566.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O8S/c1-7-37-23-15-19(10-12-21(23)39-17(4)32)26-25(28(34)38-8-2)16(3)30-29-31(26)27(33)24(40-29)14-18-9-11-20(35-5)22(13-18)36-6/h9-15,26H,7-8H2,1-6H3/b24-14+InChIKey
LAIVPPKUOZFELO-ZVHZXABRSA-NSynonyms
(E)ethyl5(4acetoxy3ethoxyphenyl)2(34dimethoxybenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)c(=Cc1ccc(c(c1)OC)OC)s2
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OC)OC)S3)C)C(=O)OCC)OC(=O)C
ethyl(2E)5(4(acetyloxy)3ethoxyphenyl)2(34dimethoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3ethoxyphenyl)2((34dimethoxyphenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H30N2O8Sc1737231519(101221(23)3917(4)32)2625(28(34)3882)16(3)302931(26)27(33)24(4029)141891120(355)22(1318)366h91526H78H216H3b2414+
MFCD01949291
ZINC000097966449
ZINC000097966450
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.