2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C16H18N2O5S MolecularWeight: 350.38952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H18N2O5S/c1-21-12-8-11(9-13(22-2)16(12)23-3)17-14(19)10-24-15-6-4-5-7-18(15)20/h4-9H,10H2,1-3H3,(H,17,19)