Vitas-M small molecule compound
[(4-methylphenyl)sulfonyl]{3-[3-(prop-2-en-1-yl)-1H-imidazol-3-ium-1-yl]quinoxalin-2-yl}azanide
Catalog ID
STK565888
SMILES C=CC[n+]1ccn(c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(cc1)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 C21H19N5O2S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2S/c1-3-12-25-13-14-26(15-25)21-20(22-18-6-4-5-7-19(18)23-21)24-29(27,28)17-10-8-16(2)9-11-17/h3-11,13-15H,1,12H2,2H3InChIKey
SLGXACOLEOTWSQ-UHFFFAOYSA-NSynonyms
((4methylphenyl)sulfonyl)(3(3(prop2en1yl)1Himidazol3ium1yl)quinoxalin2yl)azanide
(4METHYLPHENYL)SULFONYL(3(3PROP2ENYLIMIDAZOL3IUM1YL)QUINOXALIN2YL)AZANIDE
C=CC(n+)1ccn(c1)c1nc2ccccc2nc1(N)S(=O)(=O)c1ccc(cc1)C
CC1=CC=C(C=C1)S(=O)(=O)(N)C2=NC3=CC=CC=C3N=C2N4C=C(N+)(=C4)CC=C
InChI=1SC21H19N5O2Sc131225131426(1525)2120(2218645719(18)2321)2429(2728)1710816(2)91117h3111315H112H22H3
MFCD03818539
ZINC000334157044
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