3-(5-bromanylpyridin-2-yl)oxy-N-(2-oxidanylsulfonothioyloxyethyl)propan-1-amine

Systemtic Name: 3-(5-bromanylpyridin-2-yl)oxy-N-(2-oxidanylsulfonothioyloxyethyl)propan-1-amine Openeye Name: 3-[(5-bromo-2-pyridyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)propan-1-amine CAS Name: 3-[(5-bromo-2-pyridinyl)oxy]-N-(2-hydroxysulfonothioyloxyethyl)-1-propanamine IUPAC Name: 3-(5-bromopyridin-2-yl)oxy-N-(2-hydroxysulfonothioyloxyethyl)propan-1-amine Traditional Name: 3-[(5-bromo-2-pyridyl)oxy]propyl-(2-hydroxysulfonothioyloxyethyl)amine Formula: C10H15BrN2O4S2 MolecularWeight: 371.2711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15BrN2O4S2/c11-9-2-3-10(13-8-9)16-6-1-4-12-5-7-17-19(14,15)18/h2-3,8,12H,1,4-7H2,(H,14,15,18)