Identification
Name |
2-[2-[(5-Bromo-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-6-Chloro-1-(3-Sulphonatopropyl)Quinolinium |
Synonyms |
3-[2-[2-[(5-Bromo-3-Ethyl-1,3-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-6-Chloro-Quinolin-1-Ium-1-Yl]Propane-1-Sulfonate; 3-[2-[2-[(5-Bromo-3-Ethyl-1,3-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-6-Chloro-1-Quinolin-1-Iumyl]Propane-1-Sulfonate; 2-(2-((5-Bromo-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl)But-1-Enyl)-6-Chloro-1-(3-Sulphonatopropyl)Quinolinium |
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Molecular Structure |
![CAS#: 52450-03-0, 2-[2-[(5-Bromo-3-Ethyl-3H-Benzothiazol-2-Ylidene)Methyl]But-1-Enyl]-6-Chloro-1-(3-Sulphonatopropyl)Quinolinium](/moreStructures/52450-03-0.gif) |
Molecular Formula |
C26H26BrClN2O3S2 |
Molecular Weight |
593.98 |
CAS Registry Number |
52450-03-0 |
EINECS |
257-928-6 |
SMILES |
C2=C1N(C(SC1=CC=C2Br)=CC(=CC3=CC=C4C(=[N+]3CCC[S]([O-])(=O)=O)C=CC(=C4)Cl)CC)CC |
InChI |
1S/C26H26BrClN2O3S2/c1-3-18(15-26-29(4-2)24-17-20(27)7-11-25(24)34-26)14-22-9-6-19-16-21(28)8-10-23(19)30(22)12-5-13-35(31,32)33/h6-11,14-17H,3-5,12-13H2,1-2H3 |
InChIKey |
GLLQOQWZQQOWTA-UHFFFAOYSA-N |
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