Vitas-M small molecule compound

Catalog ID
STL049430
SMILES COc1cc(CCNc2nc3ccccc3[nH]/c/2=N\S(=O)(=O)c2cccc3c2nsn3)ccc1OC

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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 C24H22N6O4S2 MW 522.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O4S2/c1-33-19-11-10-15(14-20(19)34-2)12-13-25-23-24(27-17-7-4-3-6-16(17)26-23)30-36(31,32)21-9-5-8-18-22(21)29-35-28-18/h3-11,14H,12-13H2,1-2H3,(H,25,26)(H,27,30)
InChIKey
WSTOLHDOQZDBHK-UHFFFAOYSA-N
Synonyms
1004717-66-1
1004717661
COC1=C(C=C(C=C1)CCNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54)OC
COc1cc(CCNc2nc3ccccc3(nH)c2=NS(=O)(=O)c2cccc3c2nsn3)ccc1OC
InChI=1SC24H22N6O4S2c13319111015(1420(19)342)1213252324(2717743616(17)2623)3036(3132)219581822(21)29352818h31114H1213H212H3(H2526)(H2730)
MFCD05736635
N(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)QUINOXALIN2YL)213BENZOTHIADIAZOLE4SULFONAMIDE
N(3(2(34DIMETHOXYPHENYL)ETHYLAMINO)QUINOXALIN2YL)213BENZOTHIADIAZOLE4SULFONAMIDE
ZINC000002244813
ZINC02244813
ZINC2244813

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Available files

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