Vitas-M small molecule compound
ethyl {2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-bromophenoxy}acetate
Catalog ID
STK287702
SMILES CCOC(=O)COc1ccc(cc1/C=C(/c1nc2c([nH]1)cccc2)\C#N)Br
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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 C20H16BrN3O3 MW 426.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN3O3/c1-2-26-19(25)12-27-18-8-7-15(21)10-13(18)9-14(11-22)20-23-16-5-3-4-6-17(16)24-20/h3-10H,2,12H2,1H3,(H,23,24)/b14-9+InChIKey
MRYHPKPURUNOTL-NTEUORMPSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC3=CC=CC=C3N2
CCOC(=O)COc1ccc(cc1C=C(c1nc2c((nH)1)cccc2)C#N)Br
ethyl(2((E)2(1Hbenzimidazol2yl)2cyanoethenyl)4bromophenoxy)acetate
ETHYL2(2((E)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)4BROMOPHENOXY)ACETATE
InChI=1SC20H16BrN3O3c122619(25)1227188715(21)1013(18)914(1122)202316534617(16)2420h310H212H21H3(H2324)b149+
MFCD04212070
ZINC000009187087
ZINC09187087
ZINC9187087
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