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

Systemtic Name: N-(3-methylphenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-(m-tolyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-(3-methylphenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-(3-methylphenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(m-tolyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)SC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H16N2O2S/c1-11-6-5-7-13(10-11)16-15(18)12(2)20-14-8-3-4-9-17(14)19/h3-10,12H,1-2H3,(H,16,18)