Vitas-M small molecule compound
(2Z)-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-1-benzofuran-6-yl methanesulfonate
Catalog ID
STK992329
SMILES CC(c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)C)C
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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 C19H18O5S MW 358.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O5S/c1-12(2)14-6-4-13(5-7-14)10-18-19(20)16-9-8-15(11-17(16)23-18)24-25(3,21)22/h4-12H,1-3H3/b18-10-InChIKey
WYWKEGLRXMLGKK-ZDLGFXPLSA-NSynonyms
623122-61-2((2Z)3oxo2((4propan2ylphenyl)methylidene)1benzofuran6yl)methanesulfonate
(2Z)3oxo2(4(propan2yl)benzylidene)23dihydro1benzofuran6ylmethanesulfonate
(Z)2(4isopropylbenzylidene)3oxo23dihydrobenzofuran6ylmethanesulfonate
2((4(METHYLETHYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLMETHYLSULFONATE
623122612
CC(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C
CC(c1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OS(=O)(=O)C)C
InChI=1SC19H18O5Sc112(2)146413(5714)101819(20)169815(1117(16)2318)2425(321)22h412H13H3b1810
MFCD06295912
ZINC000009419108
ZINC09419108
ZINC9419108
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