Vitas-M small molecule compound
methyl 3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-{4-[2-(1H-pyrazol-1-yl)ethoxy]phenyl}propanoate
Catalog ID
STL542839
SMILES COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc(cc1)OCCn1cccn1
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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 C25H22N2O6 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6/c1-32-21(28)15-20(22-23(29)18-5-2-3-6-19(18)24(30)25(22)31)16-7-9-17(10-8-16)33-14-13-27-12-4-11-26-27/h2-12,20,31H,13-15H2,1H3InChIKey
MONIRTRCGFLYQT-UHFFFAOYSA-NSynonyms
InChI=1SC25H22N2O6c13221(28)1520(2223(29)18523619(18)24(30)25(22)31)167917(10816)33141327124112627h2122031H1315H21H3
methyl3(3hydroxy14dioxo14dihydronaphthalen2yl)3(4(2(1Hpyrazol1yl)ethoxy)phenyl)propanoate
methyl3(4(2(1Hpyrazol1yl)ethoxy)phenyl)3(3hydroxy14dioxo14dihydronaphthalen2yl)propanoate
MFCD28349048
ZINC000217672379
ZINC000217672470
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Check stock on Vitas-MAvailable files
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