2-(5-ethanoylthiophen-3-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: 2-(5-ethanoylthiophen-3-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: 2-(5-acetyl-3-thienyl)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]acetamide CAS Name: 2-(5-acetyl-3-thiophenyl)-N-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(5-acetylthiophen-3-yl)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: 2-(5-acetyl-3-thienyl)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]acetamide Formula: C18H22N3O3S+ MolecularWeight: 360.45058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)CC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

Isomeric SMILES

CC(=O)C1=CC(=CS1)CC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

InChI

InChI=1S/C18H21N3O3S/c1-13(22)16-9-14(12-25-16)10-17(23)20-11-15-3-2-4-19-18(15)21-5-7-24-8-6-21/h2-4,9,12H,5-8,10-11H2,1H3,(H,20,23)/p+1