sodium 1-(1-adamantyl)-3-[4-[2-(7-bromo-4,4-dimethyl-1,3-dioxoisoquinolin-2-yl)ethyl]phenyl]sulfonylurea
sodium 1-(1-adamantyl)-3-[4-[2-(7-bromo-4,4-dimethyl-1,3-dioxoisoquinolin-2-yl)ethyl]phenyl]sulfonylurea
| Molecular Formula | C30H34BrN3NaO5S+ |
|---|---|
| Molecular Weight | 651.6 g/mol |
| Topological Polar Surface Area | 121.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 650.13 |
| Heavy Atoms | 41 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 34723-70-1 |
|---|---|
| SMILES | CC1(C2=C(C=C(C=C2)Br)C(=O)N(C1=O)CCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NC45CC6CC(C4)CC(C6)C5)C.[Na+] |
| InChIKey | OMPDVPOHUHSOLX-UHFFFAOYSA-N |
📖 Product Overview
sodium 1-(1-adamantyl)-3-[4-[2-(7-bromo-4,4-dimethyl-1,3-dioxoisoquinolin-2-yl)ethyl]phenyl]sulfonylurea (CAS: 34723-70-1) is a chemical compound with molecular formula C30H34BrN3NaO5S+ and molecular weight 651.6 g/mol. Its IUPAC systematic name is sodium 1-(1-adamantyl)-3-[4-[2-(7-bromo-4,4-dimethyl-1,3-dioxoisoquinolin-2-yl)ethyl]phenyl]sulfonylurea.
OMPDVPOHUHSOLX-UHFFFAOYSA-N.
SMILES: CC1(C2=C(C=C(C=C2)Br)C(=O)N(C1=O)CCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NC45CC6CC(C4)CC(C6)C5)C.[Na+].
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