Vitas-M small molecule compound

6-methoxy-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-chromen-2-one

Catalog ID
STL351456
SMILES COc1ccc2c(c1)cc(c(=O)o2)c1onc(n1)c1cc(OC)c(c(c1)OC)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 C21H18N2O7 MW 410.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O7/c1-25-13-5-6-15-11(7-13)8-14(21(24)29-15)20-22-19(23-30-20)12-9-16(26-2)18(28-4)17(10-12)27-3/h5-10H,1-4H3
InChIKey
YJOQJWMFRZHHLD-UHFFFAOYSA-N
Synonyms
892759-02-3
6methoxy3(3(345trimethoxyphenyl)124oxadiazol5yl)2Hchromen2one
6methoxy3(3(345trimethoxyphenyl)124oxadiazol5yl)chromen2one
892759023
COC1=CC2=C(C=C1)OC(=O)C(=C2)C3=NC(=NO3)C4=CC(=C(C(=C4)OC)OC)OC
InChI=1SC21H18N2O7c12513561511(713)814(21(24)2915)202219(233020)12916(262)18(284)17(1012)273h510H14H3
MFCD10666913
ZINC000006868056
ZINC06868056
ZINC6868056

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.