2-((3-Ethyl-3H-benzothiazol-2-ylidene)methyl)-1-methylquinolinium iodide
(2Z)-3-ethyl-2-[(1-methylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide
Also Known As: EINECS 225-016-7|2-Quinothiacyanine iodide,1-methyl-3'-ethyl|2-((3-Ethyl-3H-benzothiazol-2-ylidene)methyl)-1-methylquinolinium iodide|2-[(3-ETHYL-3H-BENZOTHIAZOL-2-YLIDENE)METHYL]-1-METHYLQUINOLINIUM IODIDE|(2Z)-3-ethyl-2-[(1-methylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide|3-ethyl-2-[(1-methylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole,iodide|3-Ethyl-2-[(1-methylquinolin-2(1H)-ylidene)methyl]-1,3-benzothiazol-3-ium iodide
| Molecular Formula | C20H19IN2S |
|---|---|
| Molecular Weight | 446.03137 g/mol |
| LogP | 1.5989 |
| Topological Polar Surface Area | 7.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 446.03137 |
| Monoisotopic Mass | 446.03137 |
| Heavy Atoms | 24 |
| Complexity | 920.4108 |
Chemical Identifiers
| CAS Number | 4609-41-0 |
|---|---|
| SMILES | CCN\1C2=CC=CC=C2S/C1=C\C3=[N+](C4=CC=CC=C4C=C3)C.[I-] |
Product Overview
2-((3-Ethyl-3H-benzothiazol-2-ylidene)methyl)-1-methylquinolinium iodide (CAS 4609-41-0), with molecular formula C20H19IN2S and molecular weight 446.03137 g/mol. IUPAC: (2Z)-3-ethyl-2-[(1-methylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole iodide.