4-ethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-ethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-ethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiadiazole-5-carboxamide CAS Name: 4-ethyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-5-thiadiazolecarboxamide IUPAC Name: 4-ethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiadiazole-5-carboxamide Traditional Name: 4-ethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiadiazole-5-carboxamide Formula: C15H20N5O2S+ MolecularWeight: 334.4166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C15H19N5O2S/c1-2-12-14(23-19-18-12)15(21)17-10-11-3-4-13(16-9-11)20-5-7-22-8-6-20/h3-4,9H,2,5-8,10H2,1H3,(H,17,21)/p+1