N-[1-(4-fluorophenyl)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: N-[1-(4-fluorophenyl)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-[1-(4-fluorophenyl)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-[1-(4-fluorophenyl)ethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-[1-(4-fluorophenyl)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-[1-(4-fluorophenyl)ethyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C16H17FN2O2S MolecularWeight: 320.381783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17FN2O2S/c1-11(13-6-8-14(17)9-7-13)18-16(20)12(2)22-15-5-3-4-10-19(15)21/h3-12H,1-2H3,(H,18,20)