Vitas-M small molecule compound

(2Z)-2-(2-chloro-6-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-fluorobenzenesulfonate

Catalog ID
STK992331
SMILES Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

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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 C21H11ClF2O5S MW 448.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11ClF2O5S/c22-17-2-1-3-18(24)16(17)11-20-21(25)15-9-6-13(10-19(15)28-20)29-30(26,27)14-7-4-12(23)5-8-14/h1-11H/b20-11-
InChIKey
JWJKFFLWSJNNSQ-JAIQZWGSSA-N
Synonyms
929371-46-0
((2Z)2((2chloro6fluorophenyl)methylidene)3oxo1benzofuran6yl)4fluorobenzenesulfonate
(2Z)2(2chloro6fluorobenzylidene)3oxo23dihydro1benzofuran6yl4fluorobenzenesulfonate
(Z)2(2chloro6fluorobenzylidene)3oxo23dihydrobenzofuran6yl4fluorobenzenesulfonate
2((6CHLORO2FLUOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4FLUOROBENZENESULFONATE
929371460
C1=CC(=C(C(=C1)Cl)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)F)F
Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1c(F)cccc1Cl)C2=O
InChI=1SC21H11ClF2O5Sc221721318(24)16(17)112021(25)159613(1019(15)2820)2930(2627)147412(23)5814h111Hb2011
MFCD08751106
ZINC000009420258
ZINC09420258
ZINC9420258

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Available files

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