N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C16H19N3O4S2 MolecularWeight: 381.46976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O4S2/c1-12-7-8-13(25(22,23)18(2)3)10-14(12)17-15(20)11-24-16-6-4-5-9-19(16)21/h4-10H,11H2,1-3H3,(H,17,20)