Vitas-M small molecule compound
(2E)-2-{4-[(2-chlorobenzyl)oxy]-3-methoxybenzylidene}-4,4-dimethyl-3-oxopentanenitrile
Catalog ID
STK133616
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccccc1Cl)/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 C22H22ClNO3 MW 383.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClNO3/c1-22(2,3)21(25)17(13-24)11-15-9-10-19(20(12-15)26-4)27-14-16-7-5-6-8-18(16)23/h5-12H,14H2,1-4H3/b17-11+InChIKey
VQORMSWHWXHUCU-GZTJUZNOSA-NSynonyms
(2E)2((4((2CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)44DIMETHYL3OXOPENTANENITRILE
(2E)2(4((2CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)44DIMETHYL3OXOPENTANENITRILE
CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=CC=C2Cl)OC)C#N
InChI=1SC22H22ClNO3c122(23)21(25)17(1324)111591019(20(1215)264)271416756818(16)23h512H14H214H3b1711+
MFCD04572423
N#CC(=Cc1ccc(c(c1)OC)OCc1ccccc1Cl)C(=O)C(C)(C)C
ZINC000004680797
ZINC04680797
ZINC4680797
Check stock
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