5-[3,5-bis(bromanyl)pyridin-2-yl]oxy-N-(2-oxidanylsulfonothioyloxyethyl)pentan-1-amine

Systemtic Name: 5-[3,5-bis(bromanyl)pyridin-2-yl]oxy-N-(2-oxidanylsulfonothioyloxyethyl)pentan-1-amine Openeye Name: 5-[(3,5-dibromo-2-pyridyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)pentan-1-amine CAS Name: 5-[(3,5-dibromo-2-pyridinyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)-1-pentanamine IUPAC Name: 5-(3,5-dibromopyridin-2-yl)oxy-N-(2-hydroxysulfonothioyloxyethyl)pentan-1-amine Traditional Name: 5-[(3,5-dibromo-2-pyridyl)oxy]pentyl-(2-hydroxysulfonothioyloxyethyl)amine Formula: C12H18Br2N2O4S2 MolecularWeight: 478.22032

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1Br)OCCCCCNCCOS(=O)(=S)O)Br

Isomeric SMILES

C1=C(C=NC(=C1Br)OCCCCCNCCOS(=O)(=S)O)Br

InChI

InChI=1S/C12H18Br2N2O4S2/c13-10-8-11(14)12(16-9-10)19-6-3-1-2-4-15-5-7-20-22(17,18)21/h8-9,15H,1-7H2,(H,17,18,21)