Vitas-M small molecule compound
ethyl (2Z)-2-(2-bromo-4-ethoxy-5-methoxybenzylidene)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL558415
SMILES C=CCOc1ccc(cc1OCC)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cc(OC)c(cc1Br)OCC)/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 C31H33BrN2O7S MW 657.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33BrN2O7S/c1-7-13-41-22-12-11-19(14-24(22)38-8-2)28-27(30(36)40-10-4)18(5)33-31-34(28)29(35)26(42-31)16-20-15-23(37-6)25(39-9-3)17-21(20)32/h7,11-12,14-17,28H,1,8-10,13H2,2-6H3/b26-16-InChIKey
QYXMPEBICAYLEN-QQXSKIMKSA-NSynonyms
135634875
ethyl(2~(Z))2((2bromo4ethoxy5methoxyphenyl)methylidene)5(3ethoxy4prop2enoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(2bromo4ethoxy5methoxybenzylidene)5(3ethoxy4(prop2en1yloxy)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H33BrN2O7Sc17134122121119(1424(22)3882)2827(30(36)40104)18(5)333134(28)29(35)26(4231)16201523(376)25(3993)1721(20)32h71112141728H181013H226H3b2616
MFCD31750887
ZINC000214019099
ZINC000214019159
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