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CHEBI:107607 - 2-[[[3-[2-(4-methylphenyl)sulfonylethylthio]phenyl]-oxomethyl]amino]benzoic acid

Default Structure
ChEBI IDCHEBI:107607
ChEBI Name2-[[[3-[2-(4-methylphenyl)sulfonylethylthio]phenyl]-oxomethyl]amino]benzoic acid
Stars
DownloadsMolfile
FormulaC23H21NO5S2
Net Charge0
Average Mass455.557
Monoisotopic Mass455.08611
SMILESCc1ccc(S(=O)(=O)CCSc2cccc(C(=O)Nc3ccccc3C(=O)O)c2)cc1
InChIInChI=1S/C23H21NO5S2/c1-16-9-11-19(12-10-16)31(28,29)14-13-30-18-6-4-5-17(15-18)22(25)24-21-8-3-2-7-20(21)23(26)27/h2-12,15H,13-14H2,1H3,(H,24,25)(H,26,27)
InChIKeyMYDKXHMRNKHYRA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[[3-[2-(4-methylphenyl)sulfonylethylthio]phenyl]-oxomethyl]amino]benzoic acid (CHEBI:107607) is a benzamides (CHEBI:22702)
Manual XrefsDatabases
LSM-18963LINCS