1,1'-{1,3-Propanediylbis[(Dimethylammonio)-3,1-Propanediyl]}Bis{4-[(E)-(3-Methyl-1,3-Benzothiazol-2(3H)-Ylidene)Methyl]Pyridinium} Tetraiodide
[CAS# 169454-13-1]

Identification

• Name: 1,1'-{1,3-Propanediylbis[(Dimethylammonio)-3,1-Propanediyl]}Bis{4-[(E)-(3-Methyl-1,3-Benzothiazol-2(3H)-Ylidene)Methyl]Pyridinium} Tetraiodide
• Synonyms: 1,1'-{propane-1,3-diylbis[(dimethylammonio)propane-3,1-diyl]}bis{4-[(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]pyridinium} tetraiodide; 2,2'-{propane-1,3-diylbis[(dimethylammonio)propane-3,1-diylpyridin-1-yl-4-ylidenemethylylidene]}bis(3-methyl-1,3-benzothiazol-3-ium) tetraiodide; 1,1'-{propane-1,3-diylbis[(dimethylammonio)propane-3,1-diyl]}bis{4-[(Z)-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]pyridinium} tetraiodide; 2,2'-{propane-1,3-diylbis[(dimethylammonio)propane-3,1-diylpyridin-1-yl-4-ylidenemethylylidene]}bis(3-methyl-1,3-benzothiazol-3-ium) tetraiodide
• Molecular Formula: C₄₁H₅₄I₄N₆S₂
• Molecular Weight: 1202.66
• CAS Registry Number: 169454-13-1
• SMILES: [I-].[I-].[I-].[I-].S\1c6ccccc6N(C/1=C/c2cc[n+](cc2)CCC[N+](C)(C)CCC[N+](C)(C)CCC[n+]3ccc(cc3)/C=C5/Sc4ccccc4N5C)C
• InChI: 1S/C41H54N6S2.4HI/c1-42-36-14-7-9-16-38(36)48-40(42)32-34-18-24-44(25-19-34)22-11-28-46(3,4)30-13-31-47(5,6)29-12-23-45-26-20-35(21-27-45)33-41-43(2)37-15-8-10-17-39(37)49-41;;;;/h7-10,14-21,24-27,32-33H,11-13,22-23,28-31H2,1-6H3;4*1H/q+4;;;;/p-4
• InChIKey: TYBKADJAOBUHAD-UHFFFAOYSA-J

Properties

• Refractive index: (Cal.)