2,4-dimethyl-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2,4-dimethyl-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1,3-thiazole-5-carboxamide Openeye Name: 2,4-dimethyl-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]thiazole-5-carboxamide CAS Name: 2,4-dimethyl-N-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-5-thiazolecarboxamide IUPAC Name: 2,4-dimethyl-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1,3-thiazole-5-carboxamide Traditional Name: 2,4-dimethyl-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]thiazole-5-carboxamide Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

InChI

InChI=1S/C16H20N4O2S/c1-11-14(23-12(2)19-11)16(21)18-10-13-4-3-5-17-15(13)20-6-8-22-9-7-20/h3-5H,6-10H2,1-2H3,(H,18,21)/p+1