Products 63450-48-6
CAS 63450-48-6 appears in our catalog under these names: VIS-554 Trimethine-, Cyanine NEt3H+, 1 g, glass, VIS-554 Trimethine-, Cyanine NEt3H+, 5 g, plastic, VIS-554 Trimethine-, Cyanine NEt3H+, 10 g, plastic. Offered by: Roth. Available pack sizes: 1g, 5g, 10g.
4-[5-chloro-2-[2-[[5-chloro-3-(4-sulfobutyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzothiazol-3-yl]butane-1-sulfonate;N,N-diethylethanamine (CAS 63450-48-6) is a chemical compound with the molecular formula C33H45Cl2N3O6S4 and a molecular weight of 778.9 g/mol. IUPAC name: 4-[5-chloro-2-[2-[[5-chloro-3-(4-sulfobutyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzothiazol-3-yl]butane-1-sulfonate;N,N-diethylethanamine. InChIKey: RUOZVASHYBSRES-UHFFFAOYSA-N.
| Molecular formula | C33H45Cl2N3O6S4 |
|---|---|
| Molecular weight | 778.9 g/mol |
| IUPAC name | 4-[5-chloro-2-[2-[[5-chloro-3-(4-sulfobutyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-1,3-benzothiazol-3-yl]butane-1-sulfonate;N,N-diethylethanamine |
| InChIKey | RUOZVASHYBSRES-UHFFFAOYSA-N |
| SMILES | CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCCCS(=O)(=O)O)C=C3N(C4=C(S3)C=CC(=C4)Cl)CCCCS(=O)(=O)[O-].CCN(CC)CC |
Computed by PubChem (NCBI)