N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-dichloro-3-methyl-phenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-dichloro-3-methylphenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(2,6-dichloro-3-methylphenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(2,6-dichloro-3-methyl-phenyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C14H12Cl2N2O2S MolecularWeight: 343.22828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12Cl2N2O2S/c1-9-5-6-10(15)14(13(9)16)17-11(19)8-21-12-4-2-3-7-18(12)20/h2-7H,8H2,1H3,(H,17,19)