Vitas-M small molecule compound
{2-bromo-6-chloro-4-[(Z)-2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy}acetic acid
Catalog ID
STK201518
SMILES N#C/C(=C/c1cc(Cl)c(c(c1)Br)OCC(=O)O)/c1[nH]c2c(n1)cc(cc2)C
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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 C19H13BrClN3O3 MW 446.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13BrClN3O3/c1-10-2-3-15-16(4-10)24-19(23-15)12(8-22)5-11-6-13(20)18(14(21)7-11)27-9-17(25)26/h2-7H,9H2,1H3,(H,23,24)(H,25,26)/b12-5-InChIKey
GHDNLFWRSSNNLJ-XGICHPGQSA-NSynonyms
(2BROMO6CHLORO4((Z)2CYANO2(5METHYL1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)ACETICACID
2(2BROMO6CHLORO4((Z)2CYANO2(6METHYL1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)ACETICACID
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC(=O)O)Cl)C#N
InChI=1SC19H13BrClN3O3c110231516(410)2419(2315)12(822)511613(20)18(14(21)711)27917(25)26h27H9H21H3(H2324)(H2526)b125
MFCD05997598
N#CC(=Cc1cc(Cl)c(c(c1)Br)OCC(=O)O)c1(nH)c2c(n1)cc(cc2)C
ZINC000009934910
ZINC9934910
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