Vitas-M small molecule compound
2-bromo-4-{(E)-[2-({[1-(4-chlorobenzyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Catalog ID
STK569285
SMILES COc1cc(/C=N/NC(=O)CSc2[nH+]c3c(n2Cc2ccc(cc2)Cl)cccc3)cc(c1[O-])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 C24H20BrClN4O3S MW 559.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrClN4O3S/c1-33-21-11-16(10-18(25)23(21)32)12-27-29-22(31)14-34-24-28-19-4-2-3-5-20(19)30(24)13-15-6-8-17(26)9-7-15/h2-12,32H,13-14H2,1H3,(H,29,31)/b27-12+InChIKey
NAKUVAKOLWDZFB-KKMKTNMSSA-NSynonyms
2bromo4((E)(2(((1(4chlorobenzyl)1Hbenzimidazol3ium2yl)sulfanyl)acetyl)hydrazinylidene)methyl)6methoxyphenolate
COc1cc(C=NNC(=O)CSc2(nH+)c3c(n2Cc2ccc(cc2)Cl)cccc3)cc(c1(O))Br
MFCD03679614
ZINC000006136327
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