Vitas-M small molecule compound
methyl 2-{(3E)-2-(3-chlorophenyl)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL041100
SMILES COC(=O)c1sc(nc1C)N1C(c2cccc(c2)Cl)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O
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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 C25H19ClN2O7S MW 526.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN2O7S/c1-12-22(24(32)33-2)36-25(27-12)28-19(13-4-3-5-15(26)10-13)18(21(30)23(28)31)20(29)14-6-7-16-17(11-14)35-9-8-34-16/h3-7,10-11,19,29H,8-9H2,1-2H3/b20-18+InChIKey
KEVWEQAOESWGPN-CZIZESTLSA-NSynonyms
620561-76-4620561764
CC1=C(SC(=N1)N2C(C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C2=O)C5=CC(=CC=C5)Cl)C(=O)OC
COC(=O)c1sc(nc1C)N1C(c2cccc(c2)Cl)C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C1=O
InChI=1SC25H19ClN2O7Sc11222(24(32)332)3625(2712)2819(1343515(26)1013)18(21(30)23(28)31)20(29)14671617(1114)35983416h3710111929H89H212H3b2018+
methyl2((3E)2(3chlorophenyl)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
MFCD05726711
ZINC000102866821
ZINC000102866825
Check stock
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