2-[(4-cyanophenyl)methylsulfanyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 2-[(4-cyanophenyl)methylthio]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 2-[(4-cyanobenzyl)thio]-N-[3-(2-ketopyrrolidino)phenyl]benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H21N3O2S/c26-16-18-10-12-19(13-11-18)17-31-23-8-2-1-7-22(23)25(30)27-20-5-3-6-21(15-20)28-14-4-9-24(28)29/h1-3,5-8,10-13,15H,4,9,14,17H2,(H,27,30)