Vitas-M small molecule compound
ethyl (2E)-2-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzylidene]-5-(2-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL508374
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C\c1cc(CC=C)c(c(c1)OC)O)/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 C28H28N2O6S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O6S/c1-6-10-18-13-17(14-21(35-5)25(18)31)15-22-26(32)30-24(19-11-8-9-12-20(19)34-4)23(27(33)36-7-2)16(3)29-28(30)37-22/h6,8-9,11-15,24,31H,1,7,10H2,2-5H3/b22-15+InChIKey
CXDPNFXCHWMCNA-PXLXIMEGSA-NSynonyms
11840187
ethyl(2~(E))2((4hydroxy3methoxy5prop2enylphenyl)methylidene)5(2methoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2(3ALLYL4HYDROXY5METHOXYBENZYLIDENE)5(2METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)2(4hydroxy3methoxy5(prop2en1yl)benzylidene)5(2methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(3ALLYL4HYDROXY5METHOXYBENZYLIDENE)5(2METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H28N2O6Sc1610181317(1421(355)25(18)31)152226(32)3024(1911891220(19)344)23(27(33)3672)16(3)2928(30)3722h68911152431H1710H225H3b2215+
MFCD03082376
ZINC000008438583
ZINC000008438585
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