Account Benzothiazolium, 2-[2-methyl-3-[3-(3-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(3-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine
- Catalog No. :
- ACBWFX689
- CAS No. :
- 63149-02-0
- Molecular Formula :
- C32H45N3O6S4
- Molecular Weight :
- 695.99
IUPAC Name:triethylamine 4-(2-(2-methyl-3-(3-(3-sulfonatobutyl)benzo[d]thiazol-2(3H)-ylidene)prop-1-en-1-yl)benzo[d]thiazol-3-ium-3-yl)butane-2-sulfonate
![Benzothiazolium, 2-[2-methyl-3-[3-(3-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(3-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Benzothiazolium, 2-[2-methyl-3-[3-(3-sulfobutyl)-2(3H)-benzothiazolylidene]-1-propen-1-yl]-3-(3-sulfobutyl)-, inner salt, compd. with N,N-diethylethanamine |
|---|---|
| IUPAC Name | triethylamine 4-(2-(2-methyl-3-(3-(3-sulfonatobutyl)benzo[d]thiazol-2(3H)-ylidene)prop-1-en-1-yl)benzo[d]thiazol-3-ium-3-yl)butane-2-sulfonate |
| Molecular Formula | C32H45N3O6S4 |
| Molecular Weight | 695.99 |
| SMILES | CC(S(=O)([O-])=O)CC[N+]1=C(/C=C(C)/C=C2SC3=CC=CC=C3N/2CCC(S(=O)(O)=O)C)SC4=CC=CC=C14.CCN(CC)CC |
| InChI Key | KCSSBAQVWVNGSY-UHFFFAOYSA-N |
| Synonym | hydrogen 2-[2-methyl-3-[3-(3-sulphonatobutyl)-3H-benzothiazol-2-ylidene]prop-1-enyl]-3-(3-sulphonatobutyl)benzothiazolium, compound with triethylamine (1:1) |
| CAS No. | 63149-02-0 |
Synthetic Route by SureRoute
2. ACBWFX689 Molecular Building Block Synthetic Route
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
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