Vitas-M small molecule compound

ethyl 5-({6-[(Z)-{2-[(5-fluoro-1H-indol-2-yl)carbonyl]hydrazinylidene}methyl]-4,7-dimethoxy-1,3-benzodioxol-5-yl}methyl)-4,5-dihydro-1,2-oxazole-3-carboxylate

Catalog ID
STK692958
SMILES CCOC(=O)C1=NOC(C1)Cc1c(/C=N\NC(=O)c2cc3c([nH]2)ccc(c3)F)c(OC)c2c(c1OC)OCO2

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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 C26H25FN4O8 MW 540.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN4O8/c1-4-36-26(33)20-10-15(39-31-20)9-16-17(22(35-3)24-23(21(16)34-2)37-12-38-24)11-28-30-25(32)19-8-13-7-14(27)5-6-18(13)29-19/h5-8,11,15,29H,4,9-10,12H2,1-3H3,(H,30,32)/b28-11-
InChIKey
ZSOHTBNYCBXIQM-FXMZOFOKSA-N
Synonyms

CCOC(=O)C1=NOC(C1)Cc1c(C=NNC(=O)c2cc3c((nH)2)ccc(c3)F)c(OC)c2c(c1OC)OCO2
CCOC(=O)C1=NOC(C1)CC2=C(C(=C3C(=C2OC)OCO3)OC)C=NNC(=O)C4=CC5=C(N4)C=CC(=C5)F
ethyl5((6((Z)((5fluoro1Hindole2carbonyl)hydrazinylidene)methyl)47dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
ethyl5((6((Z)(2((5fluoro1Hindol2yl)carbonyl)hydrazinylidene)methyl)47dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
InChI=1SC26H25FN4O8c143626(33)201015(393120)91617(22(353)2423(21(16)342)37123824)11283025(32)19813714(27)5618(13)2919h58111529H491012H213H3(H3032)b2811
MFCD10038994
ZINC000100238633
ZINC000100238635

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Available files

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