N-[4-(4-ethoxyphenoxy)phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-ethoxyphenoxy)phenyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C21H20N2O4S/c1-2-26-17-10-12-19(13-11-17)27-18-8-6-16(7-9-18)22-20(24)15-28-21-5-3-4-14-23(21)25/h3-14H,2,15H2,1H3,(H,22,24)