2-ethyl-6-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1-(thiophen-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-ethyl-6-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1-(thiophen-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-ethyl-6-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1-(2-thienylmethyl)pyridine-3-carboxamide CAS Name: 2-ethyl-6-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-1-(thiophen-2-ylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-ethyl-6-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1-(thiophen-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-ethyl-4-keto-6-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1-(2-thenyl)nicotinamide Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C21H29N3O3S/c1-3-18-20(21(26)22-7-5-8-23-9-11-27-12-10-23)19(25)14-16(2)24(18)15-17-6-4-13-28-17/h4,6,13-14H,3,5,7-12,15H2,1-2H3,(H,22,26)/p+1