| CAS ID: | 8064-90-2 |
| Molecular Formula: | C25H30N6O6S |
| Molecular Weight: | 542.6 g/mol |
| Monoisotopic Mass: | 542.1948 g/mol |
| Class: | Small Molecule |
| Natural Product: | No |
| Other Names: | Cotrimoxazole |
| Analysis: | Drug repositioning mechanism analysis |
| InChI: | InChI=1S/C14H18N4O3.C11H12N2O3S/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;1-8-6-10(13-16-8)7-17(14,15)11-4-2-9(12)3-5-11/h5-7H,4H2,1-3H3,(H4,15,16,17,18);2-6H,7,12H2,1H3 | See All |
| InChI Key: | CTNTUFQBOKZSPI-UHFFFAOYSA-N | |
| Smiles: | COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC.Cc3onc(CS(=O)(=O)c4ccc(N)cc4)c3 | See All |
| Molfile: | Download |
Trial Record 1
| ClinicalTrial ID | NCT01777737 | Disease | Idiopathic pulmonary fibrosis |
| Phase | Phase 3 | Status | Terminated |
| First Received | January 29, 2013 | Last Verified | November 14, 2017 |
| Sponsor | Fundación Pública Andaluza para la gestión de la Investigación en Sevilla | ||
Trial Record 2
| ClinicalTrial ID | NCT01701297 | Disease | Liver fibrosis |
| Phase | Phase 2 | Status | Terminated |
| First Received | October 5, 2012 | Last Verified | October 28, 2016 |
| Sponsor | Nottingham University Hospitals NHS Trust | ||
| PubChem: | 24719 |
| ChEMBL: | CHEMBL195591 |