Vitas-M small molecule compound
7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl 3-chloro-4-methoxybenzoate
Catalog ID
STK882568
SMILES COc1ccc(cc1)c1cc(OC(=O)c2ccc(c(c2)Cl)OC)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 C22H15ClO6S MW 442.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClO6S/c1-26-14-6-3-12(4-7-14)16-10-15(11-19-20(16)29-22(25)30-19)28-21(24)13-5-8-18(27-2)17(23)9-13/h3-11H,1-2H3InChIKey
ZHHVYNHJVNFSPJ-UHFFFAOYSA-NSynonyms
(7(4methoxyphenyl)2oxo13benzoxathiol5yl)3chloro4methoxybenzoate
7(4methoxyphenyl)2oxo13benzoxathiol5yl3chloro4methoxybenzoate
COC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC(=C(C=C4)OC)Cl
InChI=1SC22H15ClO6Sc126146312(4714)161015(111920(16)2922(25)3019)2821(24)135818(272)17(23)913h311H12H3
MFCD06646275
ZINC000009430750
ZINC09430750
ZINC9430750
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