Vitas-M small molecule compound

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

Catalog ID
STK619879
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1Cl)/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 C22H15ClO5S MW 426.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClO5S/c1-14-6-9-17(10-7-14)29(25,26)28-16-8-11-18-20(13-16)27-21(22(18)24)12-15-4-2-3-5-19(15)23/h2-13H,1H3/b21-12-
InChIKey
IQGMRFWZLVWOJG-MTJSOVHGSA-N
Synonyms
929429-44-7
((2Z)2((2chlorophenyl)methylidene)3oxo1benzofuran6yl)4methylbenzenesulfonate
(2Z)2(2chlorobenzylidene)3oxo23dihydro1benzofuran6yl4methylbenzenesulfonate
(Z)2(2chlorobenzylidene)3oxo23dihydrobenzofuran6yl4methylbenzenesulfonate
2((2CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZENESULFONATE
929429447
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CC=C4Cl)O3
Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1ccccc1Cl)C2=O
InChI=1SC22H15ClO5Sc1146917(10714)29(2526)28168111820(1316)2721(22(18)24)1215423519(15)23h213H1H3b2112
MFCD08750922
ZINC000013653818
ZINC13653818

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Available files

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