N-(5-chloranylpyridin-2-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C12H10ClN3O2S MolecularWeight: 295.7447

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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