Vitas-M small molecule compound
(2E)-2-{2-[(4-fluorobenzyl)oxy]benzylidene}-4,4-dimethyl-3-oxopentanenitrile
Catalog ID
STK136057
SMILES N#C/C(=C\c1ccccc1OCc1ccc(cc1)F)/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 C21H20FNO2 MW 337.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FNO2/c1-21(2,3)20(24)17(13-23)12-16-6-4-5-7-19(16)25-14-15-8-10-18(22)11-9-15/h4-12H,14H2,1-3H3/b17-12+InChIKey
HSHLARFWAVIVQH-SFQUDFHCSA-NSynonyms
(2E)2((2((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)44DIMETHYL3OXOPENTANENITRILE
(2E)2(2((4FLUOROBENZYL)OXY)BENZYLIDENE)44DIMETHYL3OXOPENTANENITRILE
CC(C)(C)C(=O)C(=CC1=CC=CC=C1OCC2=CC=C(C=C2)F)C#N
InChI=1SC21H20FNO2c121(23)20(24)17(1323)1216645719(16)25141581018(22)11915h412H14H213H3b1712+
MFCD04251429
N#CC(=Cc1ccccc1OCc1ccc(cc1)F)C(=O)C(C)(C)C
ZINC000004681180
ZINC04681180
ZINC4681180
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