Vitas-M small molecule compound

(2Z)-2-(2,4-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate

Catalog ID
STK992307
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1Cl)Cl)/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 C22H14Cl2O5S MW 461.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2O5S/c1-13-2-7-17(8-3-13)30(26,27)29-16-6-9-18-20(12-16)28-21(22(18)25)10-14-4-5-15(23)11-19(14)24/h2-12H,1H3/b21-10-
InChIKey
GBYZTMUQUJPIRC-FBHDLOMBSA-N
Synonyms
929429-56-1
((2Z)2((24dichlorophenyl)methylidene)3oxo1benzofuran6yl)4methylbenzenesulfonate
(2Z)2(24dichlorobenzylidene)3oxo23dihydro1benzofuran6yl4methylbenzenesulfonate
(Z)2(24dichlorobenzylidene)3oxo23dihydrobenzofuran6yl4methylbenzenesulfonate
2((24DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZENESULFONATE
929429561
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=C(C=C4)Cl)Cl)O3
Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1Cl)Cl)C2=O
InChI=1SC22H14Cl2O5Sc1132717(8313)30(2627)2916691820(1216)2821(22(18)25)10144515(23)1119(14)24h212H1H3b2110
MFCD08750977
ZINC000009420093
ZINC09420093
ZINC9420093

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Available files

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