Vitas-M small molecule compound
1-(2-chlorobenzyl)-3-(4-methoxyphenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL057849
SMILES COc1ccc(cc1)c1cn(c2[n+]1CCC2)Cc1ccccc1Cl
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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 C20H20ClN2O MW 339.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN2O/c1-24-17-10-8-15(9-11-17)19-14-22(20-7-4-12-23(19)20)13-16-5-2-3-6-18(16)21/h2-3,5-6,8-11,14H,4,7,12-13H2,1H3/q+1InChIKey
TYQBVFAEPCLITM-UHFFFAOYSA-NSynonyms
1((2CHLOROPHENYL)METHYL)3(4METHOXYPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM
1(2chlorobenzyl)3(4methoxyphenyl)1567tetrahydropyrrolo(12a)imidazol4ium
COC1=CC=C(C=C1)C2=C(N+)(=C3N2CCC3)CC4=CC=CC=C4Cl
COc1ccc(cc1)c1cn(c2(n+)1CCC2)Cc1ccccc1Cl
InChI=1SC20H20ClN2Oc1241710815(91117)191422(20741223(19)20)1316523618(16)21h235681114H471213H21H3q+1
ZINC000017207961
ZINC17207961
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