Vitas-M small molecule compound

2-amino-5-(4-bromophenyl)-1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium

Catalog ID
STK117662
SMILES Brc1ccc(cc1)c1c[n+](c(n1C)N)CC(=O)c1ccccc1

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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 C18H17BrN3O MW 371.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3O/c1-21-16(13-7-9-15(19)10-8-13)11-22(18(21)20)12-17(23)14-5-3-2-4-6-14/h2-11,20H,12H2,1H3/p+1
InChIKey
RXHLZICYSPLVBR-UHFFFAOYSA-O
Synonyms

2(2AMINO4(4BROMOPHENYL)3METHYLIMIDAZOL1IUM1YL)1PHENYLETHANONE
2AMINO5(4BROMOPHENYL)1METHYL3(2OXO2PHENYLETHYL)1HIMIDAZOL3IUM
Brc1ccc(cc1)c1c(n+)(c(n1C)N)CC(=O)c1ccccc1
CN1C(=C(N+)(=C1N)CC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Br
InChI=1SC18H16BrN3Oc12116(137915(19)10813)1122(18(21)20)1217(23)145324614h21120H12H21H3p+1
MFCD09267403
ZINC000334157609
ZINC04691052
ZINC4691052

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.