N-[4-(methylsulfonylamino)phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(methylsulfonylamino)phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[4-(methanesulfonamido)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[4-(methanesulfonamido)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[4-(methanesulfonamido)phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-besyl-N-[4-(methanesulfonamido)phenyl]pyrrolidine-2-carboxamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O5S2/c1-27(23,24)20-15-11-9-14(10-12-15)19-18(22)17-8-5-13-21(17)28(25,26)16-6-3-2-4-7-16/h2-4,6-7,9-12,17,20H,5,8,13H2,1H3,(H,19,22)