Vitas-M small molecule compound

2-bromo-4-[1-(3-bromo-4-hydroxy-5-methoxybenzyl)-1H-3,1-benzimidazol-3-ium-2-yl]-6-methoxyphenolate

Catalog ID
STL047207
SMILES COc1cc(cc(c1[O-])Br)c1[nH+]c2c(n1Cc1cc(Br)c(c(c1)OC)O)cccc2

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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 C22H18Br2N2O4 MW 534.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Br2N2O4/c1-29-18-8-12(7-14(23)20(18)27)11-26-17-6-4-3-5-16(17)25-22(26)13-9-15(24)21(28)19(10-13)30-2/h3-10,27-28H,11H2,1-2H3
InChIKey
YCCQGZCMUMDAQC-UHFFFAOYSA-N
Synonyms
537010-63-2
2bromo4(1(3bromo4hydroxy5methoxybenzyl)1H31benzimidazol3ium2yl)6methoxyphenolate
COc1cc(cc(c1(O))Br)c1(nH+)c2c(n1Cc1cc(Br)c(c(c1)OC)O)cccc2

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Available files

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