| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1688656-83-8 |
| Catalog No. | 2A-3185564 |
| Chinese Name | Deferasirox Impurity E |
| Molecular Formula | H2NNHC6H4CO2H |
| Molecular Weight | 152.15 |
| PubChem ID | 193882580 |
| MDL Number | MFCD00007581 |
| SMILES | O=C(O)c1ccc(-n2nc(-c3cc(Sc4ccc(O)c(-c5nc(-c6ccccc6O)n(-c6ccc(C(=O)O)cc6)n5)c4)ccc3O)nc2-c2ccccc2O)cc1 |
| InChI | InChI=1S/C42H28N6O8S/c49-33-7-3-1-5-29(33)39-43-37(45-47(39)25-13-9-23(10-14-25)41(53)54)31-21-27(17-19-35(31)51)57-28-18-20-36(52)32(22-28)38-44-40(30-6-2-4-8-34(30)50)48(46-38)26-15-11-24(12-16-26)42(55)56/h1-22,49-52H,(H,53,54)(H,55,56) |
| InChI Key | NWETZLTWYSYMFW-UHFFFAOYSA-N |
| Beilstein/REAXYS | 387378 |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
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