Account Benzothiazolium, 5-methyl-2-[2-[[5-methyl-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine
- Catalog No. :
- ACUMNL369
- CAS No. :
- 25746-37-6
- Molecular Formula :
- C33H47N3O6S4
- Molecular Weight :
- 710.02
IUPAC Name:triethylamine 3-((E)-5-methyl-2-((E)-2-((5-methyl-3-(3-sulfonatopropyl)benzo[d]thiazol-3-ium-2-yl)methylene)butylidene)benzo[d]thiazol-3(2H)-yl)propane-1-sulfonate
![Benzothiazolium, 5-methyl-2-[2-[[5-methyl-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Benzothiazolium, 5-methyl-2-[2-[[5-methyl-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine |
|---|---|
| IUPAC Name | triethylamine 3-((E)-5-methyl-2-((E)-2-((5-methyl-3-(3-sulfonatopropyl)benzo[d]thiazol-3-ium-2-yl)methylene)butylidene)benzo[d]thiazol-3(2H)-yl)propane-1-sulfonate |
| Molecular Formula | C33H47N3O6S4 |
| Molecular Weight | 710.02 |
| SMILES | O=S(CCC[N+]1=C(/C=C(/C=C2SC3=CC=C(C)C=C3N/2CCCS(=O)(O)=O)CC)SC4=CC=C(C)C=C14)([O-])=O.CCN(CC)CC |
| InChI Key | ZVWNIZCYHTZLQZ-UHFFFAOYSA-N |
| Synonym | hydrogen 2-[[5-methyl-3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene]methyl]but-1-enyl]-3-(3-sulphonatopropyl)benzothiazolium, compound with triethylamine (1:1);2-[3-[5-Methyl-2,3-dihydro-3-(3-sulfopropyl)benzothiazole-2-ylidene]-2-ethyl-1-propenyl]-3-(3-sulfonatopropyl)-5-methylbenzothiazole-3-ium·triethylamine;3-(3-Sulfonatopropyl)-5-methyl-2-[2-ethyl-3-[3-(3-sulfopropyl)-5-methyl-2,3-dihydrobenzothiazole-2-ylidene]-1-propenyl]benzothiazole-3-ium·triethylamine;NK-2182 |
| CAS No. | 25746-37-6 |
Synthetic Route by SureRoute
2. ACUMNL369 Molecular Building Block Synthetic Route
3-(2-(2-((3-Ethyl-5-methylbenzo[d]thiazol-2(3H)-ylidene)methyl)but-1-en-1-yl)naphtho[1,2-d]thiazol-1-ium-1-yl)propane-1-sulfonate
Naphtho[1,2-d]thiazolium, 1-(3-sulfopropyl)-2-[2-[[1-(3-sulfopropyl)naphtho[1,2-d]thiazol-2(1H)-ylidene]methyl]-1-buten-1-yl]-, inner salt, compd. with N,N-diethylethanamine
Benzothiazolium, 5-chloro-2-[2-[[5-chloro-3-(3-sulfopropyl)-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-3-(3-sulfopropyl)-, inner salt, compd with N,N-diethylethanamine