| PDB CCD ID: | SAS |
| Number of entries in BioLiP: | 14 |
| Chemical formula: | C18 H14 N4 O5 S |
| InChI: | InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,23H,(H,19,22)(H,24,25)/b21-20+ |
| InChIKey: | NCEXYHBECQHGNR-QZQOTICOSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)[S](=O)(=O)Nc3ccccn3 | | ACDLabs 10.04 | O=S(=O)(Nc1ncccc1)c3ccc(/N=N/c2cc(C(=O)O)c(O)cc2)cc3 | | OpenEye OEToolkits 1.5.0 | c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)/N=N/c3ccc(c(c3)C(=O)O)O | | OpenEye OEToolkits 1.5.0 | c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)N=Nc3ccc(c(c3)C(=O)O)O |
|
| Name: | 2-HYDROXY-(5-([4-(2-PYRIDINYLAMINO)SULFONYL]PHENYL)AZO)BENZOIC ACID;
SULFASALAZINE |
| ChEMBL: | CHEMBL421 |
| DrugBank: | DB00795 |
| ZINC: | ZINC000003831490 |
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