Vitas-M small molecule compound
ethyl {2,6-dichloro-4-[(Z)-2-cyano-2-(5-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy}acetate
Catalog ID
STK201848
SMILES CCOC(=O)COc1c(Cl)cc(cc1Cl)/C=C(\c1nc2c([nH]1)ccc(c2)OC)/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 C21H17Cl2N3O4 MW 446.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3O4/c1-3-29-19(27)11-30-20-15(22)7-12(8-16(20)23)6-13(10-24)21-25-17-5-4-14(28-2)9-18(17)26-21/h4-9H,3,11H2,1-2H3,(H,25,26)/b13-6-InChIKey
MSDMDIKAOBFNKU-MLPAPPSSSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1Cl)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)OC)Cl
CCOC(=O)COc1c(Cl)cc(cc1Cl)C=C(c1nc2c((nH)1)ccc(c2)OC)C#N
ETHYL(26DICHLORO4((Z)2CYANO2(5METHOXY1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)ACETATE
ETHYL2(26DICHLORO4((Z)2CYANO2(6METHOXY1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)ACETATE
InChI=1SC21H17Cl2N3O4c132919(27)11302015(22)712(816(20)23)613(1024)2125175414(282)918(17)2621h49H311H212H3(H2526)b136
MFCD06003192
ZINC000012393115
ZINC12393115
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