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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(4-fluorobenzyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C15H15FN2O2S MolecularWeight: 306.355203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15FN2O2S/c1-11(21-14-4-2-3-9-18(14)20)15(19)17-10-12-5-7-13(16)8-6-12/h2-9,11H,10H2,1H3,(H,17,19)