2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-phenyl-propanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenyl-propanamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-phenylpropanamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-phenyl-propionamide Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)SC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C14H14N2O2S/c1-11(19-13-9-5-6-10-16(13)18)14(17)15-12-7-3-2-4-8-12/h2-11H,1H3,(H,15,17)