| SpectraBase Spectrum ID |
FfQXCeUanBv |
| Name |
5-Ethoxy-3-methyl-2-{(1E)-2-{4-{{(1E,2E)-2-{{4-[(1E)-2-(3-methyl-5-nitrobenzothiazol-3-ium-2-yl)diazenyl]phenyl}imino}ethylidene}amino}phenyl}diazenyl}benzothiazol-3-ium Bis(methyl Sulfate) |
| Alternate Name(s) |
5-Ethoxy-3-methyl-2-((E)-(4-(((1E,2E)-2-((4-((E)-(3-methyl-5-nitrobenzo[d]thiazol-3-ium-2-yl)diazenyl)phenyl)imino)ethylidene)amino)phenyl)diazenyl)benzo[d]thiazol-3-ium methyl sulfate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H33N9O11S4 |
| InChI |
InChI=1S/C32H27N9O3S2.2CH4O4S/c1-4-44-26-14-16-30-28(20-26)40(3)32(46-30)38-36-24-11-7-22(8-12-24)34-18-17-33-21-5-9-23(10-6-21)35-37-31-39(2)27-19-25(41(42)43)13-15-29(27)45-31;2*1-5-6(2,3)4/h5-20H,4H2,1-3H3;2*1H3,(H,2,3,4)/q+2;;/p-2 |
| InChIKey |
WEPNPXURAQFRKM-UHFFFAOYSA-L |
| Molecular Weight |
871.930 g/mol |
| SMILES |
c1(sc2c([n+]1C)cc(cc2)OCC)\N=N\c1ccc(cc1)\N=C\C=N\c1ccc(cc1)\N=N\c1sc2c([n+]1C)cc(cc2)[N+](=O)[O-].COS([O-])(=O)=O.COS([O-])(=O)=O |
| SPLASH |
splash10-001i-0901000000-93dcdb2832a55b28d4f5 |
| Source of Spectrum |
H-95-1555-5b |
| Wiley ID |
1784486 |
![5-Ethoxy-3-methyl-2-{(1E)-2-{4-{{(1E,2E)-2-{{4-[(1E)-2-(3-methyl-5-nitrobenzothiazol-3-ium-2-yl)diazenyl]phenyl}imino}ethylidene}amino}phenyl}diazenyl}benzothiazol-3-ium Bis(methyl Sulfate)](/api/spectrum/FfQXCeUanBv/structure.png?h=300&w=458 "5-Ethoxy-3-methyl-2-{(1E)-2-{4-{{(1E,2E)-2-{{4-[(1E)-2-(3-methyl-5-nitrobenzothiazol-3-ium-2-yl)diazenyl]phenyl}imino}ethylidene}amino}phenyl}diazenyl}benzothiazol-3-ium Bis(methyl Sulfate)")
