2-[(4-cyanophenyl)methylsulfanyl]-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide Openeye Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide CAS Name: 2-[(4-cyanophenyl)methylthio]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide Traditional Name: 2-[(4-cyanobenzyl)thio]-N-[4-(2-ketopyrrolidino)benzyl]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)CSCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)CSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21N3O2S/c22-12-16-3-5-18(6-4-16)14-27-15-20(25)23-13-17-7-9-19(10-8-17)24-11-1-2-21(24)26/h3-10H,1-2,11,13-15H2,(H,23,25)