N-[4-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]phenyl]acetamide CAS Name: N-[4-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]phenyl]acetamide Traditional Name: N-[4-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]phenyl]acetamide Formula: C15H14N2O3S MolecularWeight: 302.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H14N2O3S/c1-11(18)16-13-7-5-12(6-8-13)14(19)10-21-15-4-2-3-9-17(15)20/h2-9H,10H2,1H3,(H,16,18)