N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-naphthalen-2-ylsulfanyl-ethanamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-naphthalen-2-ylsulfanyl-ethanamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2-naphthylsulfanyl)acetamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-(2-naphthalenylthio)acetamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-2-naphthalen-2-ylsulfanylacetamide Traditional Name: 2-(2-naphthylthio)-N-[3-(1-pyrrolin-2-ylsulfamoyl)phenyl]acetamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H21N3O3S2/c26-22(15-29-19-11-10-16-5-1-2-6-17(16)13-19)24-18-7-3-8-20(14-18)30(27,28)25-21-9-4-12-23-21/h1-3,5-8,10-11,13-14H,4,9,12,15H2,(H,23,25)(H,24,26)