Vitas-M small molecule compound
(2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzenesulfonate
Catalog ID
STK650067
SMILES O=C1/C(=C/c2ccc(cc2)C(C)(C)C)/Oc2c1ccc(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 C25H22O5S MW 434.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O5S/c1-25(2,3)18-11-9-17(10-12-18)15-23-24(26)21-14-13-19(16-22(21)29-23)30-31(27,28)20-7-5-4-6-8-20/h4-16H,1-3H3/b23-15-InChIKey
LWAFWWKMFBBDIG-HAHDFKILSA-NSynonyms
929372-72-5((2Z)2((4tertbutylphenyl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2Z)2(4tertbutylbenzylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(Z)2(4(tertbutyl)benzylidene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((4(TERTBUTYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929372725
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=CC=C4
InChI=1SC25H22O5Sc125(23)1811917(101218)152324(26)21141319(1622(21)2923)3031(2728)207546820h416H13H3b2315
MFCD09847733
O=C1C(=Cc2ccc(cc2)C(C)(C)C)Oc2c1ccc(c2)OS(=O)(=O)c1ccccc1
ZINC000008990625
ZINC08990625
ZINC8990625
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