Vitas-M small molecule compound
(2Z)-2-(3-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK992422
SMILES Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)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 C21H12Cl2O5S MW 447.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12Cl2O5S/c22-14-4-7-17(8-5-14)29(25,26)28-16-6-9-18-19(12-16)27-20(21(18)24)11-13-2-1-3-15(23)10-13/h1-12H/b20-11-InChIKey
XPGHZIMFXBSDLN-JAIQZWGSSA-NSynonyms
929472-81-1((2Z)2((3chlorophenyl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2(3chlorobenzylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2(3chlorobenzylidene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((3CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929472811
C1=CC(=CC(=C1)Cl)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1cccc(c1)Cl)C2=O
InChI=1SC21H12Cl2O5Sc22144717(8514)29(2526)2816691819(1216)2720(21(18)24)111321315(23)1013h112Hb2011
MFCD09845264
ZINC000009486218
ZINC09486218
ZINC9486218
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