Vitas-M small molecule compound
3-(4-chlorophenyl)-1-[2-(3-methoxyphenyl)-2-oxoethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL042869
SMILES COc1cccc(c1)C(=O)Cn1cc([n+]2c1CCC2)c1ccc(cc1)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 C21H20ClN2O2 MW 367.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN2O2/c1-26-18-5-2-4-16(12-18)20(25)14-23-13-19(24-11-3-6-21(23)24)15-7-9-17(22)10-8-15/h2,4-5,7-10,12-13H,3,6,11,14H2,1H3/q+1InChIKey
KHQPNAJWOPEPJI-UHFFFAOYSA-NSynonyms
2(3(4CHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)1(3METHOXYPHENYL)ETHANONE
3(4chlorophenyl)1(2(3methoxyphenyl)2oxoethyl)1567tetrahydropyrrolo(12a)imidazol4ium
COC1=CC=CC(=C1)C(=O)C(N+)2=C3CCCN3C(=C2)C4=CC=C(C=C4)Cl
COc1cccc(c1)C(=O)Cn1cc((n+)2c1CCC2)c1ccc(cc1)Cl
InChI=1SC21H20ClN2O2c1261852416(1218)20(25)14231319(24113621(23)24)157917(22)10815h2457101213H361114H21H3q+1
ZINC000013769628
ZINC13769628
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