Vitas-M small molecule compound
2-amino-5-(3,4-dimethylphenyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]-1-methyl-1H-imidazol-3-ium
Catalog ID
STK136368
SMILES Fc1ccc(cc1)C(=O)C[n+]1cc(n(c1N)C)c1ccc(c(c1)C)C
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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 C20H21FN3O MW 338.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN3O/c1-13-4-5-16(10-14(13)2)18-11-24(20(22)23(18)3)12-19(25)15-6-8-17(21)9-7-15/h4-11,22H,12H2,1-3H3/p+1InChIKey
QUVVEBLRWMIYEV-UHFFFAOYSA-OSynonyms
2(2AMINO4(34DIMETHYLPHENYL)3METHYLIMIDAZOL1IUM1YL)1(4FLUOROPHENYL)ETHANONE
2AMINO5(34DIMETHYLPHENYL)3(2(4FLUOROPHENYL)2OXOETHYL)1METHYL1HIMIDAZOL3IUM
CC1=C(C=C(C=C1)C2=C(N+)(=C(N2C)N)CC(=O)C3=CC=C(C=C3)F)C
Fc1ccc(cc1)C(=O)C(n+)1cc(n(c1N)C)c1ccc(c(c1)C)C
InChI=1SC20H20FN3Oc1134516(1014(13)2)181124(20(22)23(18)3)1219(25)156817(21)9715h41122H12H213H3p+1
MFCD09267534
ZINC000334157598
ZINC04681219
ZINC4681219
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