![4-[[5-Bromo-6-chloro-2-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethyl-benzonitrile structure, CAS 269055-76-7](/structures/80000/73166_1_269055_76_7.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 269055-76-7 |
| Catalog No. | 2A-9073166 |
| Chinese Name | 6-脱氨基-6-氯四维碱-13C3 |
| Synonyms | 6-Desamino 6-Chloro Etravirine |
| Molecular Formula | C20H13BrClN5O |
| Molecular Weight | 435.28 |
| Purity | ≥98 (HPLC) |
| Appearance | powder |
| PubChem ID | 16859081 |
| MDL Number | MFCD09837879 |
| SMILES | Brc1c(nc(nc1Oc3c(cc(cc3C)C#N)C)Nc2ccc(cc2)C#N)N |
| InChI | 1S/C20H15BrN6O/c1-11-7-14(10-23)8-12(2)17(11)28-19-16(21)18(24)26-20(27-19)25-15-5-3-13(9-22)4-6-15/h3-8H,1-2H3,(H3,24,25,26,27) |
| InChI Key | PYGWGZALEOIKDF-UHFFFAOYSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/73166_1_269055_76_7.pdf |
| Transport Info | Product name: 6-deamino-6-chlorotetrahydrobase-13C3 |
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