NX4

5-[({3-[(3,4-dichlorobenzyl)sulfanyl]thiophen-2-yl}carbonyl)sulfamoyl]-2-methoxybenzoic acid


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Chemical Component Summary

Name5-[({3-[(3,4-dichlorobenzyl)sulfanyl]thiophen-2-yl}carbonyl)sulfamoyl]-2-methoxybenzoic acid
Identifiers5-[[3-[(3,4-dichlorophenyl)methylsulfanyl]thiophen-2-yl]carbonylsulfamoyl]-2-methoxy-benzoic acid
FormulaC20 H15 Cl2 N O6 S3
Molecular Weight532.437
TypeNON-POLYMER
Isomeric SMILESCOc1ccc(cc1C(=O)O)S(=O)(=O)NC(=O)c2c(ccs2)SCc3ccc(c(c3)Cl)Cl
InChIInChI=1S/C20H15Cl2NO6S3/c1-29-16-5-3-12(9-13(16)20(25)26)32(27,28)23-19(24)18-17(6-7-30-18)31-10-11-2-4-14(21)15(22)8-11/h2-9H,10H2,1H3,(H,23,24)(H,25,26)
InChIKeyHBYORZQNJPQOQI-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count49
Aromatic Bond Count17

Related Resource References

Resource NameReference
Pharos CHEMBL1910889
PubChem 54751678
ChEMBL CHEMBL1910889