Vitas-M small molecule compound
2-amino-3-[2-(4-bromophenyl)-2-oxoethyl]-5-(3-methoxyphenyl)-1-methyl-1H-imidazol-3-ium
Catalog ID
STK121155
SMILES COc1cccc(c1)c1c[n+](c(n1C)N)CC(=O)c1ccc(cc1)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 C19H19BrN3O2 MW 401.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3O2/c1-22-17(14-4-3-5-16(10-14)25-2)11-23(19(22)21)12-18(24)13-6-8-15(20)9-7-13/h3-11,21H,12H2,1-2H3/p+1InChIKey
JHTXJVIJLGYKHF-UHFFFAOYSA-OSynonyms
2(2AMINO4(3METHOXYPHENYL)3METHYLIMIDAZOL1IUM1YL)1(4BROMOPHENYL)ETHANONE
2AMINO3(2(4BROMOPHENYL)2OXOETHYL)5(3METHOXYPHENYL)1METHYL1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC=C(C=C2)Br)C3=CC(=CC=C3)OC
COc1cccc(c1)c1c(n+)(c(n1C)N)CC(=O)c1ccc(cc1)Br
InChI=1SC19H18BrN3O2c12217(1443516(1014)252)1123(19(22)21)1218(24)136815(20)9713h31121H12H212H3p+1
MFCD04395281
ZINC000334157544
ZINC04698672
ZINC4698672
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