N-(2-chloranylpyridin-3-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C12H10ClN3O2S MolecularWeight: 295.7447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=O)NC2=C(N=CC=C2)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=O)NC2=C(N=CC=C2)Cl)[O-]

InChI

InChI=1S/C12H10ClN3O2S/c13-12-9(4-3-6-14-12)15-10(17)8-19-11-5-1-2-7-16(11)18/h1-7H,8H2,(H,15,17)