Vitas-M small molecule compound
[(4-chlorophenyl)sulfonyl]{3-[3-(3-methylbutyl)-1H-imidazol-3-ium-1-yl]quinoxalin-2-yl}azanide
Catalog ID
STK564116
SMILES CC(CC[n+]1ccn(c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(cc1)Cl)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 C22H22ClN5O2S MW 455.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O2S/c1-16(2)11-12-27-13-14-28(15-27)22-21(24-19-5-3-4-6-20(19)25-22)26-31(29,30)18-9-7-17(23)8-10-18/h3-10,13-16H,11-12H2,1-2H3InChIKey
DEQFJWBVUSTABV-UHFFFAOYSA-NSynonyms
((4chlorophenyl)sulfonyl)(3(3(3methylbutyl)1Himidazol3ium1yl)quinoxalin2yl)azanide
(4CHLOROPHENYL)SULFONYL(3(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)QUINOXALIN2YL)AZANIDE
CC(C)CC(N+)1=CN(C=C1)C2=NC3=CC=CC=C3N=C2(N)S(=O)(=O)C4=CC=C(C=C4)Cl
CC(CC(n+)1ccn(c1)c1nc2ccccc2nc1(N)S(=O)(=O)c1ccc(cc1)Cl)C
InChI=1SC22H22ClN5O2Sc116(2)111227131428(1527)2221(2419534620(19)2522)2631(2930)189717(23)81018h3101316H1112H212H3
MFCD03808719
ZINC000334156998
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