N-methyl-N-[(4-methylphenyl)methyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-methyl-N-[(4-methylphenyl)methyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-methyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(p-tolylmethyl)acetamide CAS Name: N-methyl-N-[(4-methylphenyl)methyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-methyl-N-[(4-methylphenyl)methyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-methyl-N-(4-methylbenzyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H18N2O2S/c1-13-6-8-14(9-7-13)11-17(2)15(19)12-21-16-5-3-4-10-18(16)20/h3-10H,11-12H2,1-2H3