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

Systemtic Name: N-(2-ethylphenyl)-2-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]acetamide Formula: C17H19N3O3S MolecularWeight: 345.41606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C17H19N3O3S/c1-2-13-7-3-4-8-14(13)19-15(21)11-18-16(22)12-24-17-9-5-6-10-20(17)23/h3-10H,2,11-12H2,1H3,(H,18,22)(H,19,21)