Vitas-M small molecule compound
(2Z)-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzenesulfonate
Catalog ID
STK992425
SMILES Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=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 C22H16O5S MW 392.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16O5S/c1-15-6-5-7-16(12-15)13-21-22(23)19-11-10-17(14-20(19)26-21)27-28(24,25)18-8-3-2-4-9-18/h2-14H,1H3/b21-13-InChIKey
AUUIIDYHMIARCK-BKUYFWCQSA-NSynonyms
929505-71-5((2Z)2((3methylphenyl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2Z)2(3methylbenzylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(Z)2(3methylbenzylidene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((3METHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929505715
CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=CC=C4
Cc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1
InChI=1SC22H16O5Sc11565716(1215)132122(23)19111017(1420(19)2621)2728(2425)188324918h214H1H3b2113
MFCD09848252
ZINC000008991982
ZINC08991982
ZINC8991982
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