N-(4-chlorophenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-chlorophenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-(4-chlorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-(4-chlorophenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-(4-chlorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(4-chlorophenyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O2S/c1-10(20-13-4-2-3-9-17(13)19)14(18)16-12-7-5-11(15)6-8-12/h2-10H,1H3,(H,16,18)