N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[(2-fluorophenyl)methylsulfanyl]benzamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[(2-fluorophenyl)methylsulfanyl]benzamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[(2-fluorophenyl)methylsulfanyl]benzamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[(2-fluorophenyl)methylthio]benzamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-[(2-fluorophenyl)methylsulfanyl]benzamide Traditional Name: 2-[(2-fluorobenzyl)thio]-N-[3-(1-pyrrolin-2-ylsulfamoyl)phenyl]benzamide Formula: C24H22FN3O3S2 MolecularWeight: 483.578183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4F

Isomeric SMILES

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4F

InChI

InChI=1S/C24H22FN3O3S2/c25-21-11-3-1-7-17(21)16-32-22-12-4-2-10-20(22)24(29)27-18-8-5-9-19(15-18)33(30,31)28-23-13-6-14-26-23/h1-5,7-12,15H,6,13-14,16H2,(H,26,28)(H,27,29)