Vitas-M small molecule compound
[3-(3-butyl-1H-imidazol-3-ium-1-yl)quinoxalin-2-yl][(4-chlorophenyl)sulfonyl]azanide
Catalog ID
STL046025
SMILES CCCC[n+]1ccn(c1)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 C21H20ClN5O2S MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O2S/c1-2-3-12-26-13-14-27(15-26)21-20(23-18-6-4-5-7-19(18)24-21)25-30(28,29)17-10-8-16(22)9-11-17/h4-11,13-15H,2-3,12H2,1H3InChIKey
FCIVOXBAMIWHDG-UHFFFAOYSA-NSynonyms
(3(3butyl1Himidazol3ium1yl)quinoxalin2yl)((4chlorophenyl)sulfonyl)azanide
(3(3BUTYLIMIDAZOL3IUM1YL)QUINOXALIN2YL)(4CHLOROPHENYL)SULFONYLAZANIDE
CCCC(N+)1=CN(C=C1)C2=NC3=CC=CC=C3N=C2(N)S(=O)(=O)C4=CC=C(C=C4)Cl
CCCC(n+)1ccn(c1)c1nc2ccccc2nc1(N)S(=O)(=O)c1ccc(cc1)Cl
InChI=1SC21H20ClN5O2Sc1231226131427(1526)2120(2318645719(18)2421)2530(2829)1710816(22)91117h4111315H2312H21H3
MFCD03795619
ZINC000334156959
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