Vitas-M small molecule compound
ethyl 2-{(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL051889
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(c(c1)OCC)OCCC(C)C
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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 C33H36N2O9S MW 636.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N2O9S/c1-6-40-24-16-20(8-10-22(24)42-13-12-18(3)4)27-26(28(36)21-9-11-23-25(17-21)44-15-14-43-23)29(37)31(38)35(27)33-34-19(5)30(45-33)32(39)41-7-2/h8-11,16-18,27,36H,6-7,12-15H2,1-5H3/b28-26+InChIKey
DUCWJVUCEVKFER-BYCLXTJYSA-NSynonyms
620563-29-3620563293
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1ccc(c(c1)OCC)OCCC(C)C
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC(=C(S5)C(=O)OCC)C)OCCC(C)C
ethyl2((3E)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)2(3ethoxy4(3methylbutoxy)phenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC33H36N2O9Sc1640241620(81022(24)42131218(3)4)2726(28(36)219112325(1721)4415144323)29(37)31(38)35(27)333419(5)30(4533)32(39)4172h81116182736H671215H215H3b2826+
MFCD05735343
ZINC000150445300
ZINC000150445304
Check stock
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