EMBL-EBI | Chemical Biology | ChEBI
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| Formula | H2O.C12H9N2O3S.Na |
| Net Charge | 0 |
| Average Mass | 302.287 |
| Monoisotopic Mass | 302.03372 |
| SMILES | CSc1ccc2ncn(/C=C/C(=O)[O-])c(=O)c2c1.O.[Na+] |
| InChI | InChI=1S/C12H10N2O3S.Na.H2O/c1-18-8-2-3-10-9(6-8)12(17)14(7-13-10)5-4-11(15)16;;/h2-7H,1H3,(H,15,16);;1H2/q;+1;/p-1/b5-4+;; |
| InChIKey | HVCXVHOWMRZPBE-SFKRKKMESA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| tiacrilast sodium (CHEBI:756363) is a quinazolines (CHEBI:38530) |
| Synonyms | Source |
|---|---|
| RO 22-3747/007 | ChEMBL |
| RO-22-3747/007 | ChEMBL |
| RO-223747007 | ChEMBL |
| Tiacrilast sodium | ChEMBL |