N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H19N6O3S+ MolecularWeight: 411.45756

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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(C=C3)N4C=NC=N4

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C19H18N6O3S/c26-19(14-6-8-16(9-7-14)25-13-20-12-22-25)23-15-3-1-4-17(11-15)29(27,28)24-18-5-2-10-21-18/h1,3-4,6-9,11-13H,2,5,10H2,(H,21,24)(H,23,26)/p+1