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The molecular formula is C4H2BrN3S.
The compound was created on August 19, 2012.
The InChI is InChI=1S/C4H2BrN3S/c5-3-2(1-6)8-4(7)9-3/h(H2,7,8).
The Canonical SMILES is C(#N)C1=C(SC(=N1)N)Br.
The molecular weight is 204.05 g/mol.
It has 1 hydrogen bond donor count.
It has 4 hydrogen bond acceptor counts.
The topological polar surface area is 90.9?2.
There are 9 heavy atoms.
Yes, it is a canonicalized compound.
944747-11-9
944-78-5
944794-82-5
944804-88-0
944805-60-1
944808-08-6
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![1H-Isoindole-1,3(2H)-dione,4-[2-(1,4-dihydro-2-hydroxy-1-methyl-4-oxo-3-quinolinyl)diazenyl]-2-[1-(methoxymethyl)propyl]-](https://resource.alfa-chemistry.com/structure/944747-11-9.gif)
