2-[methyl-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[methyl-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[methyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[methyl-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[methyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[methyl-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]-N-[2-(methylthio)phenyl]acetamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C17H19N3O3S2/c1-19(16(22)12-25-17-9-5-6-10-20(17)23)11-15(21)18-13-7-3-4-8-14(13)24-2/h3-10H,11-12H2,1-2H3,(H,18,21)