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

Systemtic Name: N-(2-bromophenyl)-2-[methyl-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]amino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[methyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[methyl-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[methyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[methyl-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]acetamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H16BrN3O3S/c1-19(10-14(21)18-13-7-3-2-6-12(13)17)15(22)11-24-16-8-4-5-9-20(16)23/h2-9H,10-11H2,1H3,(H,18,21)