N-(2-methoxy-5-methyl-phenyl)-2-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-[[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]acetamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O4S/c1-12-6-7-14(24-2)13(9-12)19-15(21)10-18-16(22)11-25-17-5-3-4-8-20(17)23/h3-9H,10-11H2,1-2H3,(H,18,22)(H,19,21)