Vitas-M small molecule compound
2-amino-5-(4-ethoxyphenyl)-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-1H-imidazol-3-ium
Catalog ID
STK132954
SMILES CCOc1ccc(cc1)c1c[n+](c(n1C)N)CC(=O)c1cccc(c1)[N+](=O)[O-]
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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 C20H21N4O4 MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4/c1-3-28-17-9-7-14(8-10-17)18-12-23(20(21)22(18)2)13-19(25)15-5-4-6-16(11-15)24(26)27/h4-12,21H,3,13H2,1-2H3/p+1InChIKey
ZERKKMUDKFXBEG-UHFFFAOYSA-OSynonyms
2(2AMINO4(4ETHOXYPHENYL)3METHYLIMIDAZOL1IUM1YL)1(3NITROPHENYL)ETHANONE
2AMINO5(4ETHOXYPHENYL)1METHYL3(2(3NITROPHENYL)2OXOETHYL)1HIMIDAZOL3IUM
CCOC1=CC=C(C=C1)C2=C(N+)(=C(N2C)N)CC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
CCOc1ccc(cc1)c1c(n+)(c(n1C)N)CC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H20N4O4c1328179714(81017)181223(20(21)22(18)2)1319(25)1554616(1115)24(26)27h41221H313H212H3p+1
MFCD09267516
ZINC000334157658
ZINC04715867
ZINC4715867
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