Vitas-M small molecule compound
2-amino-5-(1,3-benzodioxol-5-yl)-1-methyl-3-[2-(4-methylphenyl)-2-oxoethyl]-1H-imidazol-3-ium
Catalog ID
STK121575
SMILES Cc1ccc(cc1)C(=O)C[n+]1cc(n(c1N)C)c1ccc2c(c1)OCO2
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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 C20H20N3O3 MW 350.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O3/c1-13-3-5-14(6-4-13)17(24)11-23-10-16(22(2)20(23)21)15-7-8-18-19(9-15)26-12-25-18/h3-10,21H,11-12H2,1-2H3/p+1InChIKey
REUBGZFSRDMXPR-UHFFFAOYSA-OSynonyms
2(2AMINO4(13BENZODIOXOL5YL)3METHYLIMIDAZOL1IUM1YL)1(4METHYLPHENYL)ETHANONE
2AMINO5(13BENZODIOXOL5YL)1METHYL3(2(4METHYLPHENYL)2OXOETHYL)1HIMIDAZOL3IUM
CC1=CC=C(C=C1)C(=O)C(N+)2=C(N(C(=C2)C3=CC4=C(C=C3)OCO4)C)N
Cc1ccc(cc1)C(=O)C(n+)1cc(n(c1N)C)c1ccc2c(c1)OCO2
InChI=1SC20H19N3O3c1133514(6413)17(24)11231016(22(2)20(23)21)15781819(915)26122518h31021H1112H212H3p+1
MFCD04385235
ZINC000334157605
ZINC04698772
ZINC4698772
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