Vitas-M small molecule compound

4-{[4-(2-methylphenyl)piperazin-1-yl]sulfonyl}-2,1,3-benzothiadiazole

Catalog ID
STK469589
SMILES Cc1ccccc1N1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

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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 C17H18N4O2S2 MW 374.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O2S2/c1-13-5-2-3-7-15(13)20-9-11-21(12-10-20)25(22,23)16-8-4-6-14-17(16)19-24-18-14/h2-8H,9-12H2,1H3
InChIKey
XOVFTGFAJJBMSV-UHFFFAOYSA-N
Synonyms

4((4(2methylphenyl)piperazin1yl)sulfonyl)213benzothiadiazole
4((4(2METHYLPHENYL)PIPERAZINYL)SULFONYL)BENZO(C)125THIADIAZOLE
4(4(2METHYLPHENYL)PIPERAZIN1YL)SULFONYL213BENZOTHIADIAZOLE
CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43
InChI=1SC17H18N4O2S2c113523715(13)2091121(121020)25(2223)168461417(16)19241814h28H912H21H3
MFCD06041954
ZINC000017076660
ZINC17076660

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Available files

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