N-(2-methylphenyl)-2-[4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[4-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(o-tolyl)-2-[4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]thiazol-2-yl]acetamide CAS Name: N-(2-methylphenyl)-2-[4-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-methylphenyl)-2-[4-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(o-tolyl)-2-[4-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]thiazol-2-yl]acetamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C18H17N3O2S2/c1-13-6-2-3-7-15(13)20-16(22)10-17-19-14(11-24-17)12-25-18-8-4-5-9-21(18)23/h2-9,11H,10,12H2,1H3,(H,20,22)