N-(5-chloranyl-2-methyl-phenyl)-2-[ethyl-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]amino]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[ethyl-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]amino]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[ethyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[ethyl-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[ethyl-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[ethyl-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]amino]acetamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C18H20ClN3O3S/c1-3-21(17(24)12-26-18-6-4-5-9-22(18)25)11-16(23)20-15-10-14(19)8-7-13(15)2/h4-10H,3,11-12H2,1-2H3,(H,20,23)