N-(2-bromophenyl)-2-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]acetamide Formula: C15H14BrN3O3S MolecularWeight: 396.25896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CNC(=O)CSC2=CC=CC=[N+]2[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CNC(=O)CSC2=CC=CC=[N+]2[O-])Br

InChI

InChI=1S/C15H14BrN3O3S/c16-11-5-1-2-6-12(11)18-13(20)9-17-14(21)10-23-15-7-3-4-8-19(15)22/h1-8H,9-10H2,(H,17,21)(H,18,20)