Vitas-M small molecule compound

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

Catalog ID
STK117424
SMILES Cn1c(N)[n+](cc1c1cccc(c1)[N+](=O)[O-])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 C18H17N4O3 MW 337.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c1-20-16(14-8-5-9-15(10-14)22(24)25)11-21(18(20)19)12-17(23)13-6-3-2-4-7-13/h2-11,19H,12H2,1H3/p+1
InChIKey
DXGCGWSYXAETCM-UHFFFAOYSA-O
Synonyms

2(2AMINO3METHYL4(3NITROPHENYL)IMIDAZOL1IUM1YL)1PHENYLETHANONE
2AMINO1METHYL5(3NITROPHENYL)3(2OXO2PHENYLETHYL)1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC=CC=C2)C3=CC(=CC=C3)(N+)(=O)(O)
Cn1c(N)(n+)(cc1c1cccc(c1)(N+)(=O)(O))CC(=O)c1ccccc1
InChI=1SC18H16N4O3c12016(1485915(1014)22(24)25)1121(18(20)19)1217(23)136324713h21119H12H21H3p+1
MFCD09267399
ZINC000334157512
ZINC04691012
ZINC4691012

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Available files

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