Vitas-M small molecule compound

[(4-chlorophenyl)sulfonyl][3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetonitrile

Catalog ID
STK546090
SMILES N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCN(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 C21H20ClN5O2S MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O2S/c1-26-10-12-27(13-11-26)21-20(24-17-4-2-3-5-18(17)25-21)19(14-23)30(28,29)16-8-6-15(22)7-9-16/h2-9,19H,10-13H2,1H3
InChIKey
RFDDSOKKPJPZHR-UHFFFAOYSA-N
Synonyms
797773-54-7
((4chlorophenyl)sulfonyl)(3(4methylpiperazin1yl)quinoxalin2yl)acetonitrile
(2R)((4CHLOROPHENYL)SULFONYL)(3(4METHYLPIPERAZIN1YL)QUINOXALIN2YL)ETHANENITRILE
(2S)((4CHLOROPHENYL)SULFONYL)(3(4METHYLPIPERAZIN1YL)QUINOXALIN2YL)ETHANENITRILE
2((4chlorophenyl)sulfonyl)2(3(4methylpiperazin1yl)quinoxalin2yl)acetonitrile
2(4CHLOROPHENYL)SULFONYL2(3(4METHYLPIPERAZIN1YL)QUINOXALIN2YL)ACETONITRILE
797773547
CN1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)Cl
InChI=1SC21H20ClN5O2Sc126101227(131126)2120(2417423518(17)2521)19(1423)30(2829)168615(22)7916h2919H1013H21H3
MFCD03666237
ZINC000002376212
ZINC000002376213

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.