Vitas-M small molecule compound
7-(4-chlorophenyl)-2-oxo-1,3-benzoxathiol-5-yl 3-methoxybenzoate
Catalog ID
STK515639
SMILES COc1cccc(c1)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/c1-25-15-4-2-3-13(9-15)20(23)26-16-10-17(12-5-7-14(22)8-6-12)19-18(11-16)28-21(24)27-19/h2-11H,1H3InChIKey
IGRUTVDFQVNRQU-UHFFFAOYSA-NSynonyms
(7(4chlorophenyl)2oxo13benzoxathiol5yl)3methoxybenzoate
7(4chlorophenyl)2oxo13benzoxathiol5yl3methoxybenzoate
COC1=CC=CC(=C1)C(=O)OC2=CC3=C(C(=C2)C4=CC=C(C=C4)Cl)OC(=O)S3
InChI=1SC21H13ClO5Sc1251542313(915)20(23)26161017(125714(22)8612)1918(1116)2821(24)2719h211H1H3
MFCD06645309
ZINC000006809703
ZINC06809703
ZINC6809703
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