| PDB CCD ID: | WYZ |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C21 H21 N3 O7 S2 |
| InChI: | InChI=1S/C21H21N3O7S2/c22-32(27,28)19-8-6-16(7-9-19)13-24(33(29,30)20-5-2-10-23-12-20)14-17-3-1-4-18(11-17)31-15-21(25)26/h1-12H,13-15H2,(H,25,26)(H2,22,27,28) |
| InChIKey: | BUKOXPGUCJWGKN-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | c1cc(cc(c1)OCC(=O)O)CN(Cc2ccc(cc2)S(=O)(=O)N)S(=O)(=O)c3cccnc3 | | OpenEye OEToolkits 2.0.7 | c1cc(cc(c1)OCC(=O)O)C[N@](Cc2ccc(cc2)S(=O)(=O)N)S(=O)(=O)c3cccnc3 | | CACTVS 3.385 | N[S](=O)(=O)c1ccc(CN(Cc2cccc(OCC(O)=O)c2)[S](=O)(=O)c3cccnc3)cc1 |
|
| Name: | 2-[3-[[pyridin-3-ylsulfonyl-[(4-sulfamoylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid;
2-(3-((N-(4-sulfamoylbenzyl)pyridine-3-sulfonamido)methyl)phenoxy)acetic acid |
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