4-(5-bromanylpyridin-2-yl)oxy-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine

Systemtic Name: 4-(5-bromanylpyridin-2-yl)oxy-N-(2-oxidanylsulfonothioyloxyethyl)butan-1-amine Openeye Name: 4-[(5-bromo-2-pyridyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)butan-1-amine CAS Name: 4-[(5-bromo-2-pyridinyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)-1-butanamine IUPAC Name: 4-(5-bromopyridin-2-yl)oxy-N-(2-hydroxysulfonothioyloxyethyl)butan-1-amine Traditional Name: 4-[(5-bromo-2-pyridyl)oxy]butyl-(2-hydroxysulfonothioyloxyethyl)amine Formula: C11H17BrN2O4S2 MolecularWeight: 385.29768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1Br)OCCCCNCCOS(=O)(=S)O

Isomeric SMILES

C1=CC(=NC=C1Br)OCCCCNCCOS(=O)(=S)O

InChI

InChI=1S/C11H17BrN2O4S2/c12-10-3-4-11(14-9-10)17-7-2-1-5-13-6-8-18-20(15,16)19/h3-4,9,13H,1-2,5-8H2,(H,15,16,19)