N-(2-morpholin-4-ylpyridin-1-ium-3-yl)-2,1,3-benzothiadiazole-4-carboxamide

Systemtic Name: N-(2-morpholin-4-ylpyridin-1-ium-3-yl)-2,1,3-benzothiadiazole-4-carboxamide Openeye Name: N-(2-morpholinopyridin-1-ium-3-yl)-2,1,3-benzothiadiazole-4-carboxamide CAS Name: N-[2-(4-morpholinyl)-3-pyridin-1-iumyl]-2,1,3-benzothiadiazole-4-carboxamide IUPAC Name: N-(2-morpholin-4-ylpyridin-1-ium-3-yl)-2,1,3-benzothiadiazole-4-carboxamide Traditional Name: N-(2-morpholinopyridin-1-ium-3-yl)piazthiole-4-carboxamide Formula: C16H16N5O2S+ MolecularWeight: 342.39554

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=[NH+]2)NC(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1COCCN1C2=C(C=CC=[NH+]2)NC(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C16H15N5O2S/c22-16(11-3-1-4-12-14(11)20-24-19-12)18-13-5-2-6-17-15(13)21-7-9-23-10-8-21/h1-6H,7-10H2,(H,18,22)/p+1