Vitas-M small molecule compound

7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl 3-methyl-1-benzofuran-2-carboxylate

Catalog ID
STK516393
SMILES COc1ccc(cc1)c1cc(cc2c1oc(=O)s2)OC(=O)c1oc2c(c1C)cccc2

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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 C24H16O6S MW 432.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16O6S/c1-13-17-5-3-4-6-19(17)29-21(13)23(25)28-16-11-18(14-7-9-15(27-2)10-8-14)22-20(12-16)31-24(26)30-22/h3-12H,1-2H3
InChIKey
ADTDXPJNDCHXPP-UHFFFAOYSA-N
Synonyms

(7(4methoxyphenyl)2oxo13benzoxathiol5yl)3methyl1benzofuran2carboxylate
7(4methoxyphenyl)2oxo13benzoxathiol5yl3methyl1benzofuran2carboxylate
CC1=C(OC2=CC=CC=C12)C(=O)OC3=CC4=C(C(=C3)C5=CC=C(C=C5)OC)OC(=O)S4
InChI=1SC24H16O6Sc11317534619(17)2921(13)23(25)28161118(147915(272)10814)2220(1216)3124(26)3022h312H12H3
MFCD06645645
ZINC000016742316
ZINC16742316

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Available files

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