Vitas-M small molecule compound

[(4-chlorophenyl)sulfonyl][3-(3-pentyl-1H-benzimidazol-3-ium-1-yl)quinoxalin-2-yl]azanide

Catalog ID
STL038183
SMILES CCCCC[n+]1cn(c2c1cccc2)c1nc2ccccc2nc1[N-]S(=O)(=O)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 C26H24ClN5O2S MW 506.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN5O2S/c1-2-3-8-17-31-18-32(24-12-7-6-11-23(24)31)26-25(28-21-9-4-5-10-22(21)29-26)30-35(33,34)20-15-13-19(27)14-16-20/h4-7,9-16,18H,2-3,8,17H2,1H3
InChIKey
HLFMFQHAOOYGGU-UHFFFAOYSA-N
Synonyms

((4chlorophenyl)sulfonyl)(3(3pentyl1Hbenzimidazol3ium1yl)quinoxalin2yl)azanide
(4CHLOROPHENYL)SULFONYL(3(3PENTYLBENZIMIDAZOL3IUM1YL)QUINOXALIN2YL)AZANIDE
CCCCC(N+)1=CN(C2=CC=CC=C21)C3=NC4=CC=CC=C4N=C3(N)S(=O)(=O)C5=CC=C(C=C5)Cl
CCCCC(n+)1cn(c2c1cccc2)c1nc2ccccc2nc1(N)S(=O)(=O)c1ccc(cc1)Cl
InChI=1SC26H24ClN5O2Sc123817311832(2412761123(24)31)2625(28219451022(21)2926)3035(3334)20151319(27)141620h4791618H23817H21H3
MFCD03819127
ZINC000334157039
ZINC09348618

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Available files

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