CAS 53533-50-9 is the registry number for DiSC18(3). Offered by: MedChemExpress. Available pack sizes: Get quote.
(2Z)-3-octadecyl-2-[(E)-3-(3-octadecyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole perchlorate (CAS 53533-50-9) is a chemical compound with the molecular formula C53H85ClN2O4S2 and a molecular weight of 913.8 g/mol. IUPAC name: (2Z)-3-octadecyl-2-[(E)-3-(3-octadecyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole perchlorate. InChIKey: OPYVTERQQUMURQ-UHFFFAOYSA-M.
| Molecular formula | C53H85ClN2O4S2 |
|---|---|
| Molecular weight | 913.8 g/mol |
| IUPAC name | (2Z)-3-octadecyl-2-[(E)-3-(3-octadecyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole perchlorate |
| InChIKey | OPYVTERQQUMURQ-UHFFFAOYSA-M |
| SMILES | CCCCCCCCCCCCCCCCCCN\1C2=CC=CC=C2S/C1=C\C=C\C3=[N+](C4=CC=CC=C4S3)CCCCCCCCCCCCCCCCCC.[O-]Cl(=O)(=O)=O |
Computed by PubChem (NCBI)