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

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H15N3O3S2/c1-23-13-7-5-12(6-8-13)14-10-25-17(18-14)19-15(21)11-24-16-4-2-3-9-20(16)22/h2-10H,11H2,1H3,(H,18,19,21)