Bis{2-[(2-bromo-4-methylphenyl)amino]-2-oxoethyl} 2,2'-sulfanediyldiacetate

ChemSpider ID: 2855120
Molecular Formula: C₂₂H₂₂Br₂N₂O₆S
Average mass: 602.292908 Da
Monoisotopic mass: 599.956543 Da
Systematic name

Bis{2-[(2-bromo-4-methylphenyl)amino]-2-oxoethyl} 2,2'-sulfanediyldiacetate
SMILES and InChIs

SMILES:

Brc2cc(ccc2NC(=O)COC(=O)CSCC(=O)OCC(=O)Nc1ccc(cc1Br)C)C Copied

Std. InChI:

InChI=1S/C22H22Br2N2O6S/c1-13-3-5-17(15(23)7-13)25-19(27)9-31-21(29)11-33-12-22(30)32-10-20(28)26-18-6-4-14(2)8-16(18)24/h3-8H,9-12H2,1-2H3,(H,25,27)(H,26,28) Copied

Std. InChIKey:

BWISQMZHDYKLHV-UHFFFAOYSA-N Copied
Cite this record
CSID:2855120, http://www.chemspider.com/Chemical-Structure.2855120.html (accessed 13:53, May 23, 2013) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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