Vitas-M small molecule compound

7-(4-chlorophenyl)-2-oxo-1,3-benzoxathiol-5-yl 4-methoxybenzoate

Catalog ID
STK820485
SMILES COc1ccc(cc1)C(=O)Oc1cc2sc(=O)oc2c(c1)c1ccc(cc1)Cl

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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 C21H13ClO5S MW 412.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClO5S/c1-25-15-8-4-13(5-9-15)20(23)26-16-10-17(12-2-6-14(22)7-3-12)19-18(11-16)28-21(24)27-19/h2-11H,1H3
InChIKey
ZWXMCAHAAYBYML-UHFFFAOYSA-N
Synonyms

(7(4chlorophenyl)2oxo13benzoxathiol5yl)4methoxybenzoate
7(4chlorophenyl)2oxo13benzoxathiol5yl4methoxybenzoate
COC1=CC=C(C=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)Cl)OC(=O)S3
InChI=1SC21H13ClO5Sc125158413(5915)20(23)26161017(122614(22)7312)1918(1116)2821(24)2719h211H1H3
MFCD06645303
ZINC000006809701
ZINC06809701
ZINC6809701

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Available files

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