Vitas-M small molecule compound

7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl furan-2-carboxylate

Catalog ID
STK851240
SMILES COc1cccc(c1)c1cc(OC(=O)c2ccco2)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 C19H12O6S MW 368.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12O6S/c1-22-12-5-2-4-11(8-12)14-9-13(10-16-17(14)25-19(21)26-16)24-18(20)15-6-3-7-23-15/h2-10H,1H3
InChIKey
OBLPGWRMZUWSDD-UHFFFAOYSA-N
Synonyms
879956-71-5
(7(3METHOXYPHENYL)2OXO13BENZOXATHIOL5YL)FURAN2CARBOXYLATE
7(3methoxyphenyl)2oxo13benzoxathiol5ylfuran2carboxylate
7(3methoxyphenyl)2oxobenzo(d)(13)oxathiol5ylfuran2carboxylate
879956715
COC1=CC=CC(=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC=CO4
InChI=1SC19H12O6Sc1221252411(812)14913(101617(14)2519(21)2616)2418(20)156372315h210H1H3
MFCD06646609
ZINC000005451792
ZINC05451792
ZINC5451792

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Available files

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