Account 2-(5-(3,3-Dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
- Catalog No. :
- ACXUIW189
- CAS No. :
- 1617572-09-4
- Molecular Formula :
- C35H41N3O7S2
- Molecular Weight :
- 679.86
IUPAC Name:2-((1E,3E)-5-((Z)-3,3-dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
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Product Information
| Product Name | 2-(5-(3,3-Dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate |
|---|---|
| IUPAC Name | 2-((1E,3E)-5-((Z)-3,3-dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate |
| Molecular Formula | C35H41N3O7S2 |
| Molecular Weight | 679.86 |
| SMILES | O=S(C1=CC2=C([N+](C)=C(C=CC=CC=C3N(CCCCCC(NCC#C)=O)C4=C(C=C(S(=O)(O)=O)C=C4)C3(C)C)C2(C)C)C=C1)([O-])=O |
| InChI Key | OMSGSPNJNVQTSN-UHFFFAOYSA-N |
| Synonym | 3H-Indolium, 2-[5-[1,3-dihydro-3,3-dimethyl-1-[6-oxo-6-(2-propyn-1-ylamino)hexyl]-5-sulfo-2H-indol-2-ylidene]-1,3-pentadien-1-yl]-1,3,3-trimethyl-5-sulfo-, inner salt, ion(1-);sulfo Cy5(Me) YNE.TEA;Sulfo-Cy5 alkyne（Methyl) |
| CAS No. | 1617572-09-4 |
Synthetic Route by SureRoute
2. ACXUIW189 Molecular Building Block Synthetic Route
Sodium 2-(5-(3,3-dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfonatoindolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
Sodium 2-(3-(3,3-dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfonatoindolin-2-ylidene)prop-1-en-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
2-(3-(3,3-Dimethyl-1-(6-oxo-6-(prop-2-yn-1-ylamino)hexyl)-5-sulfoindolin-2-ylidene)prop-1-en-1-yl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate