Vitas-M small molecule compound
(2Z)-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK992390
SMILES Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)C)/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/c1-14-3-2-4-15(11-14)12-21-22(24)19-10-7-17(13-20(19)27-21)28-29(25,26)18-8-5-16(23)6-9-18/h2-13H,1H3/b21-12-InChIKey
YGDKRWHBKSECKE-MTJSOVHGSA-NSynonyms
929372-68-9((2Z)2((3methylphenyl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2(3methylbenzylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2(3methylbenzylidene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((3METHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929372689
CC1=CC=CC(=C1)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)C)C2=O
InChI=1SC22H15ClO5Sc11432415(1114)122122(24)1910717(1320(19)2721)2829(2526)188516(23)6918h213H1H3b2112
MFCD09847630
ZINC000008990380
ZINC08990380
ZINC8990380
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