2-butyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-[4-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]isoindoline-5-carboxamide Formula: C23H25N4O5S+ MolecularWeight: 469.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=[NH+]CCC4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=[NH+]CCC4

InChI

InChI=1S/C23H24N4O5S/c1-2-3-13-27-22(29)18-11-6-15(14-19(18)23(27)30)21(28)25-16-7-9-17(10-8-16)33(31,32)26-20-5-4-12-24-20/h6-11,14H,2-5,12-13H2,1H3,(H,24,26)(H,25,28)/p+1