5,6-bis(chloranyl)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 5,6-bis(chloranyl)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]pyridine-3-carboxamide Openeye Name: 5,6-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]pyridine-3-carboxamide CAS Name: 5,6-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 5,6-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]pyridine-3-carboxamide Traditional Name: 5,6-dichloro-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]nicotinamide Formula: C16H15Cl2N4O3S+ MolecularWeight: 414.2863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(N=C3)Cl)Cl

InChI

InChI=1S/C16H14Cl2N4O3S/c17-13-7-10(9-20-15(13)18)16(23)21-11-3-1-4-12(8-11)26(24,25)22-14-5-2-6-19-14/h1,3-4,7-9H,2,5-6H2,(H,19,22)(H,21,23)/p+1