Vitas-M small molecule compound
(2E)-2-{4-[(2,6-dichlorobenzyl)oxy]-3-ethoxybenzylidene}-4,4-dimethyl-3-oxopentanenitrile
Catalog ID
STK137815
SMILES CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)/C=C(/C(=O)C(C)(C)C)\C#N
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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 C23H23Cl2NO3 MW 432.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23Cl2NO3/c1-5-28-21-12-15(11-16(13-26)22(27)23(2,3)4)9-10-20(21)29-14-17-18(24)7-6-8-19(17)25/h6-12H,5,14H2,1-4H3/b16-11+InChIKey
AYXOPEKSDRKNJZ-LFIBNONCSA-NSynonyms
(2E)2((4((26DICHLOROPHENYL)METHOXY)3ETHOXYPHENYL)METHYLIDENE)44DIMETHYL3OXOPENTANENITRILE
(2E)2(4((26DICHLOROBENZYL)OXY)3ETHOXYBENZYLIDENE)44DIMETHYL3OXOPENTANENITRILE
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C(C)(C)C)OCC2=C(C=CC=C2Cl)Cl
CCOc1cc(ccc1OCc1c(Cl)cccc1Cl)C=C(C(=O)C(C)(C)C)C#N
InChI=1SC23H23Cl2NO3c1528211215(1116(1326)22(27)23(23)4)91020(21)29141718(24)76819(17)25h612H514H214H3b1611+
MFCD04533944
ZINC000009851560
ZINC09851560
ZINC9851560
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