Vitas-M small molecule compound
7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl 3,4,6-trimethyl-1-benzofuran-2-carboxylate
Catalog ID
STK516387
SMILES COc1ccc(cc1)c1cc(OC(=O)c2oc3c(c2C)c(C)cc(c3)C)cc2c1oc(=O)s2
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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 C26H20O6S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O6S/c1-13-9-14(2)22-15(3)23(31-20(22)10-13)25(27)30-18-11-19(16-5-7-17(29-4)8-6-16)24-21(12-18)33-26(28)32-24/h5-12H,1-4H3InChIKey
APTOUSWCLDCXDP-UHFFFAOYSA-NSynonyms
(7(4methoxyphenyl)2oxo13benzoxathiol5yl)346trimethyl1benzofuran2carboxylate
7(4methoxyphenyl)2oxo13benzoxathiol5yl346trimethyl1benzofuran2carboxylate
CC1=CC(=C2C(=C(OC2=C1)C(=O)OC3=CC4=C(C(=C3)C5=CC=C(C=C5)OC)OC(=O)S4)C)C
InChI=1SC26H20O6Sc113914(2)2215(3)23(3120(22)1013)25(27)30181119(165717(294)8616)2421(1218)3326(28)3224h512H14H3
MFCD06645640
ZINC000009430747
ZINC09430747
ZINC9430747
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Check stock on Vitas-MAvailable files
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