2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-[4-(trifluoromethyl)phenyl]propionamide Formula: C15H13F3N2O2S MolecularWeight: 342.33613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13F3N2O2S/c1-10(23-13-4-2-3-9-20(13)22)14(21)19-12-7-5-11(6-8-12)15(16,17)18/h2-10H,1H3,(H,19,21)