Vitas-M small molecule compound
2-amino-3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-5-(3,4-dichlorophenyl)-1-methyl-1H-imidazol-3-ium
Catalog ID
STK118090
SMILES O=C(c1ccc2c(c1)OCO2)C[n+]1cc(n(c1N)C)c1ccc(c(c1)Cl)Cl
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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 C19H16Cl2N3O3 MW 405.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Cl2N3O3/c1-23-15(11-2-4-13(20)14(21)6-11)8-24(19(23)22)9-16(25)12-3-5-17-18(7-12)27-10-26-17/h2-8,22H,9-10H2,1H3/p+1InChIKey
RCIBFIBGSLAHNJ-UHFFFAOYSA-OSynonyms
2(2AMINO4(34DICHLOROPHENYL)3METHYLIMIDAZOL1IUM1YL)1(13BENZODIOXOL5YL)ETHANONE
2AMINO3(2(13BENZODIOXOL5YL)2OXOETHYL)5(34DICHLOROPHENYL)1METHYL1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC3=C(C=C2)OCO3)C4=CC(=C(C=C4)Cl)Cl
InChI=1SC19H15Cl2N3O3c12315(112413(20)14(21)611)824(19(23)22)916(25)12351718(712)27102617h2822H910H21H3p+1
MFCD09267410
O=C(c1ccc2c(c1)OCO2)C(n+)1cc(n(c1N)C)c1ccc(c(c1)Cl)Cl
ZINC000334157602
ZINC04691147
ZINC4691147
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