4-(2-oxidanylidenepyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 4-(2-oxidanylidenepyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 4-(2-oxopyrrolidin-1-yl)-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 4-(2-oxo-1-pyrrolidinyl)-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 4-(2-oxopyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

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