Vitas-M small molecule compound
(2E)-2-{4-[(2,4-dichlorobenzyl)oxy]benzylidene}-4,4-dimethyl-3-oxopentanenitrile
Catalog ID
STK415178
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1Cl)Cl)/C(=O)C(C)(C)C
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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 C21H19Cl2NO2 MW 388.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2NO2/c1-21(2,3)20(25)16(12-24)10-14-4-8-18(9-5-14)26-13-15-6-7-17(22)11-19(15)23/h4-11H,13H2,1-3H3/b16-10+InChIKey
DZUKBGLMFZOOFK-MHWRWJLKSA-NSynonyms
(2E)2((4((24dichlorophenyl)methoxy)phenyl)methylidene)44dimethyl3oxopentanenitrile
(2E)2(4((24dichlorobenzyl)oxy)benzylidene)44dimethyl3oxopentanenitrile
CC(C)(C)C(=O)C(=CC1=CC=C(C=C1)OCC2=C(C=C(C=C2)Cl)Cl)C#N
InChI=1SC21H19Cl2NO2c121(23)20(25)16(1224)10144818(9514)2613156717(22)1119(15)23h411H13H213H3b1610+
MFCD04538996
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1Cl)Cl)C(=O)C(C)(C)C
ZINC000006313357
ZINC06313357
ZINC6313357
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