Vitas-M small molecule compound
methyl 3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate
Catalog ID
STL320220
SMILES COC(=O)CC(c1c(O)n[nH]c1C)c1cc(OC)c2c(c1)OCCO2
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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 C17H20N2O6 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O6/c1-9-15(17(21)19-18-9)11(8-14(20)23-3)10-6-12(22-2)16-13(7-10)24-4-5-25-16/h6-7,11H,4-5,8H2,1-3H3,(H2,18,19,21)InChIKey
OMZVHHNLVIBDFO-UHFFFAOYSA-NSynonyms
1436000-47-31436000473
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC3=C(C(=C2)OC)OCCO3
COC(=O)CC(c1c(O)n(nH)c1C)c1cc(OC)c2c(c1)OCCO2
InChI=1SC17H20N2O6c1915(17(21)19189)11(814(20)233)10612(222)1613(710)24452516h6711H458H213H3(H2181921)
methyl3(3hydroxy5methyl1Hpyrazol4yl)3(8methoxy23dihydro14benzodioxin6yl)propanoate
methyl3(5methoxy23dihydro14benzodioxin7yl)3(3methyl5oxo12dihydropyrazol4yl)propanoate
MFCD28029371
ZINC000095480650
ZINC000095480651
Check stock
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Check stock on Vitas-MAvailable files
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