Vitas-M small molecule compound
2-amino-5-(1,3-benzodioxol-5-yl)-3-[2-(3-chlorophenyl)-2-oxoethyl]-1-methyl-1H-imidazol-3-ium
Catalog ID
STK124777
SMILES Clc1cccc(c1)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 C19H17ClN3O3 MW 370.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3/c1-22-15(12-5-6-17-18(8-12)26-11-25-17)9-23(19(22)21)10-16(24)13-3-2-4-14(20)7-13/h2-9,21H,10-11H2,1H3/p+1InChIKey
FVXLAXAHMBRCEN-UHFFFAOYSA-OSynonyms
2(2AMINO4(13BENZODIOXOL5YL)3METHYLIMIDAZOL1IUM1YL)1(3CHLOROPHENYL)ETHANONE
2AMINO5(13BENZODIOXOL5YL)3(2(3CHLOROPHENYL)2OXOETHYL)1METHYL1HIMIDAZOL3IUM
Clc1cccc(c1)C(=O)C(n+)1cc(n(c1N)C)c1ccc2c(c1)OCO2
CN1C(=C(N+)(=C1N)CC(=O)C2=CC(=CC=C2)Cl)C3=CC4=C(C=C3)OCO4
InChI=1SC19H16ClN3O3c12215(12561718(812)26112517)923(19(22)21)1016(24)1332414(20)713h2921H1011H21H3p+1
MFCD04386953
ZINC000334157520
ZINC04699688
ZINC4699688
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