Vitas-M small molecule compound
(2E)-3-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-2-[(4-methylphenyl)carbonyl]prop-2-enenitrile
Catalog ID
STK249109
SMILES CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C(/C(=O)c1ccc(cc1)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 C26H21Cl2NO3 MW 466.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2NO3/c1-3-31-25-14-18(12-21(15-29)26(30)20-8-4-17(2)5-9-20)7-11-24(25)32-16-19-6-10-22(27)23(28)13-19/h4-14H,3,16H2,1-2H3/b21-12+InChIKey
LHJCMHWDHVWUBN-CIAFOILYSA-NSynonyms
(2E)3(4((34dichlorobenzyl)oxy)3ethoxyphenyl)2((4methylphenyl)carbonyl)prop2enenitrile
(E)3(4((34dichlorophenyl)methoxy)3ethoxyphenyl)2(4methylbenzoyl)prop2enenitrile
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)C)OCC3=CC(=C(C=C3)Cl)Cl
CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C(C(=O)c1ccc(cc1)C)C#N
InChI=1SC26H21Cl2NO3c1331251418(1221(1529)26(30)208417(2)5920)71124(25)32161961022(27)23(28)1319h414H316H212H3b2112+
MFCD08680889
ZINC000009668274
ZINC09668274
ZINC9668274
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