Vitas-M small molecule compound
7-(2-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl benzoate
Catalog ID
STK883667
SMILES O=c1oc2c(s1)cc(cc2c1ccccc1C)OC(=O)c1ccccc1
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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 C21H14O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14O4S/c1-13-7-5-6-10-16(13)17-11-15(12-18-19(17)25-21(23)26-18)24-20(22)14-8-3-2-4-9-14/h2-12H,1H3InChIKey
ZNJSFGVZDYWBFH-UHFFFAOYSA-NSynonyms
(7(2methylphenyl)2oxo13benzoxathiol5yl)benzoate
7(2methylphenyl)2oxo13benzoxathiol5ylbenzoate
CC1=CC=CC=C1C2=CC(=CC3=C2OC(=O)S3)OC(=O)C4=CC=CC=C4
InChI=1SC21H14O4Sc1137561016(13)171115(121819(17)2521(23)2618)2420(22)148324914h212H1H3
MFCD06647257
ZINC000006809724
ZINC06809724
ZINC6809724
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