Vitas-M small molecule compound
methyl 2-{(3E)-2-(4-butoxy-3-ethoxyphenyl)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL052480
SMILES CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
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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 C32H34N2O8S MW 606.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O8S/c1-6-8-13-41-23-12-9-19(16-24(23)40-7-2)26-25(27(35)20-10-11-22-21(15-20)14-17(3)42-22)28(36)30(37)34(26)32-33-18(4)29(43-32)31(38)39-5/h9-12,15-17,26,35H,6-8,13-14H2,1-5H3/b27-25+InChIKey
UPPQUOIYUXXAIC-IMVLJIQESA-NSynonyms
893701-17-2893701172
CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NC(=C(S5)C(=O)OC)C)OCC
CCCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
InChI=1SC32H34N2O8Sc16813412312919(1624(23)4072)2625(27(35)2010112221(1520)1417(3)4222)28(36)30(37)34(26)323318(4)29(4332)31(38)395h91215172635H681314H215H3b2725+
methyl2((3E)2(4butoxy3ethoxyphenyl)3(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
MFCD05727551
ZINC000102890073
ZINC000102890080
Check stock
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Check stock on Vitas-MAvailable files
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