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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H16N2O2S/c1-12(20-14-9-5-6-10-17(14)19)15(18)16-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,16,18)