Vitas-M small molecule compound
(2E)-3-{2-bromo-4-[(3,4-dichlorobenzyl)oxy]-5-methoxyphenyl}-2-cyanoprop-2-enamide
Catalog ID
STK183567
SMILES N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccc(c(c1)Cl)Cl)/C(=O)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 C18H13BrCl2N2O3 MW 456.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrCl2N2O3/c1-25-16-6-11(5-12(8-22)18(23)24)13(19)7-17(16)26-9-10-2-3-14(20)15(21)4-10/h2-7H,9H2,1H3,(H2,23,24)/b12-5+InChIKey
WSRAQZOJWBJBKZ-LFYBBSHMSA-NSynonyms
(2E)3(2BROMO4((34DICHLOROBENZYL)OXY)5METHOXYPHENYL)2CYANOPROP2ENAMIDE
(E)3(2BROMO4((34DICHLOROPHENYL)METHOXY)5METHOXYPHENYL)2CYANOPROP2ENAMIDE
COC1=C(C=C(C(=C1)C=C(C#N)C(=O)N)Br)OCC2=CC(=C(C=C2)Cl)Cl
InChI=1SC18H13BrCl2N2O3c12516611(512(822)18(23)24)13(19)717(16)269102314(20)15(21)410h27H9H21H3(H22324)b125+
MFCD06664430
N#CC(=Cc1cc(OC)c(cc1Br)OCc1ccc(c(c1)Cl)Cl)C(=O)N
ZINC000009235180
ZINC09235180
ZINC9235180
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