N-(3-ethanoylphenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-(3-acetylphenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-(3-acetylphenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-(3-acetylphenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c1-11(19)13-6-5-7-14(10-13)17-16(20)12(2)22-15-8-3-4-9-18(15)21/h3-10,12H,1-2H3,(H,17,20)