Vitas-M small molecule compound
7-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl 2-methylbenzoate
Catalog ID
STK515840
SMILES Cc1ccc(cc1)c1cc(OC(=O)c2ccccc2C)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 C22H16O4S MW 376.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16O4S/c1-13-7-9-15(10-8-13)18-11-16(12-19-20(18)26-22(24)27-19)25-21(23)17-6-4-3-5-14(17)2/h3-12H,1-2H3InChIKey
JBYLMOMTXHQGTO-UHFFFAOYSA-NSynonyms
(7(4methylphenyl)2oxo13benzoxathiol5yl)2methylbenzoate
7(4methylphenyl)2oxo13benzoxathiol5yl2methylbenzoate
CC1=CC=C(C=C1)C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC=CC=C4C
InChI=1SC22H16O4Sc1137915(10813)181116(121920(18)2622(24)2719)2521(23)17643514(17)2h312H12H3
MFCD06645406
ZINC000006809662
ZINC06809662
ZINC6809662
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