Vitas-M small molecule compound
2-amino-5-(1,3-benzodioxol-5-yl)-1-methyl-3-(2-oxo-2-phenylethyl)-1H-imidazol-3-ium
Catalog ID
STK124412
SMILES Cn1c(N)[n+](cc1c1ccc2c(c1)OCO2)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 C19H18N3O3 MW 336.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O3/c1-21-15(14-7-8-17-18(9-14)25-12-24-17)10-22(19(21)20)11-16(23)13-5-3-2-4-6-13/h2-10,20H,11-12H2,1H3/p+1InChIKey
PKKCVDOYYQZIAR-UHFFFAOYSA-OSynonyms
2(2AMINO4(13BENZODIOXOL5YL)3METHYLIMIDAZOL1IUM1YL)1PHENYLETHANONE
2AMINO5(13BENZODIOXOL5YL)1METHYL3(2OXO2PHENYLETHYL)1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4
Cn1c(N)(n+)(cc1c1ccc2c(c1)OCO2)CC(=O)c1ccccc1
InChI=1SC19H17N3O3c12115(14781718(914)25122417)1022(19(21)20)1116(23)135324613h21020H1112H21H3p+1
MFCD04379668
ZINC000334157589
ZINC04699610
ZINC4699610
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