N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thieno[3,2-b][1]benzothiole-2-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thieno[3,2-b][1]benzothiole-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thieno[3,2-b]benzothiophene-2-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-thieno[3,2-b][1]benzothiolecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thieno[3,2-b][1]benzothiole-2-carboxamide Traditional Name: N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]thieno[3,2-b]benzothiophene-2-carboxamide Formula: C21H18N3O3S3+ MolecularWeight: 456.58092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(S3)C5=CC=CC=C5S4

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(S3)C5=CC=CC=C5S4

InChI

InChI=1S/C21H17N3O3S3/c25-21(18-12-17-20(29-18)15-7-1-2-8-16(15)28-17)23-13-5-3-6-14(11-13)30(26,27)24-19-9-4-10-22-19/h1-3,5-8,11-12H,4,9-10H2,(H,22,24)(H,23,25)/p+1