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

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenylthiazol-4-yl)acetamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenyl-4-thiazolyl)acetamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide Traditional Name: 2-(2-phenylthiazol-4-yl)-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]acetamide Formula: C21H21N4O3S2+ MolecularWeight: 441.54644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3S2/c26-20(13-17-14-29-21(24-17)15-6-2-1-3-7-15)23-16-8-4-9-18(12-16)30(27,28)25-19-10-5-11-22-19/h1-4,6-9,12,14H,5,10-11,13H2,(H,22,25)(H,23,26)/p+1