Vitas-M small molecule compound
4-bromo-2-{[(1-octyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Catalog ID
STL038082
SMILES CCCCCCCCn1c(NCc2cc(Br)ccc2[O-])[nH+]c2c1cccc2
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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 C22H28BrN3O MW 430.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28BrN3O/c1-2-3-4-5-6-9-14-26-20-11-8-7-10-19(20)25-22(26)24-16-17-15-18(23)12-13-21(17)27/h7-8,10-13,15,27H,2-6,9,14,16H2,1H3,(H,24,25)InChIKey
PWUHFMGJAIGCFS-UHFFFAOYSA-NSynonyms
371925-34-7371925347
4bromo2(((1octyl1H31benzimidazol3ium2yl)amino)methyl)phenolate
CCCCCCCCn1c(NCc2cc(Br)ccc2(O))(nH+)c2c1cccc2
MFCD03007290
ZINC000001824855
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