2-[6-[3,5-bis(bromanyl)pyridin-2-yl]oxyhexylamino]ethanethiol; sulfuric acid

Systemtic Name: 2-[6-[3,5-bis(bromanyl)pyridin-2-yl]oxyhexylamino]ethanethiol; sulfuric acid Openeye Name: 2-[6-[(3,5-dibromo-2-pyridyl)oxy]hexylamino]ethanethiol; sulfuric acid CAS Name: 2-[6-[(3,5-dibromo-2-pyridinyl)oxy]hexylamino]ethanethiol; sulfuric acid IUPAC Name: 2-[6-(3,5-dibromopyridin-2-yl)oxyhexylamino]ethanethiol; sulfuric acid Traditional Name: 2-[6-[(3,5-dibromo-2-pyridyl)oxy]hexylamino]ethanethiol; sulfuric acid Formula: C13H22Br2N2O5S2 MolecularWeight: 510.26218

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1Br)OCCCCCCNCCS)Br.OS(=O)(=O)O

Isomeric SMILES

C1=C(C=NC(=C1Br)OCCCCCCNCCS)Br.OS(=O)(=O)O

InChI

InChI=1S/C13H20Br2N2OS.H2O4S/c14-11-9-12(15)13(17-10-11)18-7-4-2-1-3-5-16-6-8-19;1-5(2,3)4/h9-10,16,19H,1-8H2;(H2,1,2,3,4)