Vitas-M small molecule compound
[(4-bromophenyl)sulfonyl]{3-[3-(3-methylbutyl)-1H-benzimidazol-3-ium-1-yl]quinoxalin-2-yl}azanide
Catalog ID
STL037542
SMILES CC(CC[n+]1cn(c2c1cccc2)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(cc1)Br)C
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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 C26H24BrN5O2S MW 550.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrN5O2S/c1-18(2)15-16-31-17-32(24-10-6-5-9-23(24)31)26-25(28-21-7-3-4-8-22(21)29-26)30-35(33,34)20-13-11-19(27)12-14-20/h3-14,17-18H,15-16H2,1-2H3InChIKey
QEJLPWDADSYIOT-UHFFFAOYSA-NSynonyms
((4bromophenyl)sulfonyl)(3(3(3methylbutyl)1Hbenzimidazol3ium1yl)quinoxalin2yl)azanide
(4BROMOPHENYL)SULFONYL(3(3(3METHYLBUTYL)BENZIMIDAZOL3IUM1YL)QUINOXALIN2YL)AZANIDE
CC(C)CC(N+)1=CN(C2=CC=CC=C21)C3=NC4=CC=CC=C4N=C3(N)S(=O)(=O)C5=CC=C(C=C5)Br
CC(CC(n+)1cn(c2c1cccc2)c1nc2ccccc2nc1(N)S(=O)(=O)c1ccc(cc1)Br)C
InChI=1SC26H24BrN5O2Sc118(2)1516311732(241065923(24)31)2625(2821734822(21)2926)3035(3334)20131119(27)121420h3141718H1516H212H3
MFCD03804782
ZINC000334156983
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