Vitas-M small molecule compound
7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl (4-chlorophenoxy)acetate
Catalog ID
STK883066
SMILES COc1cccc(c1)c1cc(OC(=O)COc2ccc(cc2)Cl)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/c1-26-16-4-2-3-13(9-16)18-10-17(11-19-21(18)29-22(25)30-19)28-20(24)12-27-15-7-5-14(23)6-8-15/h2-11H,12H2,1H3InChIKey
DUTCWPGMZGAJOR-UHFFFAOYSA-NSynonyms
(7(3methoxyphenyl)2oxo13benzoxathiol5yl)2(4chlorophenoxy)acetate
7(3methoxyphenyl)2oxo13benzoxathiol5yl(4chlorophenoxy)acetate
COC1=CC=CC(=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)COC4=CC=C(C=C4)Cl
InChI=1SC22H15ClO6Sc1261642313(916)181017(111921(18)2922(25)3019)2820(24)1227157514(23)6815h211H12H21H3
MFCD06646612
ZINC000009430768
ZINC09430768
ZINC9430768
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