Vitas-M small molecule compound
ethyl (2E)-2-(4-{[(3-bromophenyl)carbonyl]oxy}-3-methoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL558426
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(c(c1)OC)OC(=O)c1cccc(c1)Br)/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 C32H27BrN2O7S MW 663.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27BrN2O7S/c1-5-41-31(38)27-18(2)34-32-35(28(27)20-10-12-23(39-3)13-11-20)29(36)26(43-32)16-19-9-14-24(25(15-19)40-4)42-30(37)21-7-6-8-22(33)17-21/h6-17,28H,5H2,1-4H3/b26-16+InChIKey
XXEVUSFEPAHUCL-WGOQTCKBSA-NSynonyms
21172674
ethyl(2~(E))2((4(3bromobenzoyl)oxy3methoxyphenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(4(((3bromophenyl)carbonyl)oxy)3methoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC32H27BrN2O7Sc154131(38)2718(2)343235(28(27)20101223(393)131120)29(36)26(4332)161991424(25(1519)404)4230(37)2176822(33)1721h61728H5H214H3b2616+
MFCD04083775
ZINC000150467787
ZINC000150467791
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