N-[2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethyl]furan-2-carboxamide

Systemtic Name: N-[2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethyl]furan-2-carboxamide Openeye Name: N-[2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethyl]furan-2-carboxamide CAS Name: N-[2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazin-1-iumyl]ethyl]-2-furancarboxamide IUPAC Name: N-[2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethyl]furan-2-carboxamide Traditional Name: N-[2-(4-piazthiol-4-ylsulfonylpiperazin-1-ium-1-yl)ethyl]-2-furamide Formula: C17H20N5O4S2+ MolecularWeight: 422.5018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H19N5O4S2/c23-17(14-4-2-12-26-14)18-6-7-21-8-10-22(11-9-21)28(24,25)15-5-1-3-13-16(15)20-27-19-13/h1-5,12H,6-11H2,(H,18,23)/p+1