N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide Openeye Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-methyl-thiazole-4-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridin-1-iumyl]methyl]-2-methyl-4-thiazolecarboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide Traditional Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-methyl-thiazole-4-carboxamide Formula: C13H17N4OS+ MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)NCC2=C([NH+]=CC=C2)N(C)C

Isomeric SMILES

CC1=NC(=CS1)C(=O)NCC2=C([NH+]=CC=C2)N(C)C

InChI

InChI=1S/C13H16N4OS/c1-9-16-11(8-19-9)13(18)15-7-10-5-4-6-14-12(10)17(2)3/h4-6,8H,7H2,1-3H3,(H,15,18)/p+1