N-[4-methyl-3-[1-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethyl]phenyl]ethanamide

Systemtic Name: N-[4-methyl-3-[1-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethyl]phenyl]ethanamide Openeye Name: N-[4-methyl-3-[1-(1-oxidopyridin-1-ium-2-yl)sulfanylethyl]phenyl]acetamide CAS Name: N-[4-methyl-3-[1-[(1-oxido-2-pyridin-1-iumyl)thio]ethyl]phenyl]acetamide IUPAC Name: N-[4-methyl-3-[1-(1-oxidopyridin-1-ium-2-yl)sulfanylethyl]phenyl]acetamide Traditional Name: N-[4-methyl-3-[1-[(1-oxidopyridin-1-ium-2-yl)thio]ethyl]phenyl]acetamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C)C(C)SC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C)C(C)SC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H18N2O2S/c1-11-7-8-14(17-13(3)19)10-15(11)12(2)21-16-6-4-5-9-18(16)20/h4-10,12H,1-3H3,(H,17,19)