N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-ketopyrrolidino)benzenesulfonamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H27N3O5S2/c26-22-6-5-17-25(22)19-9-13-20(14-10-19)31(27,28)23-18-7-11-21(12-8-18)32(29,30)24-15-3-1-2-4-16-24/h7-14,23H,1-6,15-17H2