3-[(4-fluorophenyl)methylsulfanyl]-N-phenethyl-3-pyrrolidin-2-yl-propanamide

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-phenethyl-3-pyrrolidin-2-yl-propanamide Openeye Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-phenethyl-3-pyrrolidin-2-yl-propanamide CAS Name: 3-[(4-fluorophenyl)methylthio]-N-phenethyl-3-(2-pyrrolidinyl)propanamide IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-phenethyl-3-pyrrolidin-2-ylpropanamide Traditional Name: 3-[(4-fluorobenzyl)thio]-N-phenethyl-3-pyrrolidin-2-yl-propionamide Formula: C22H27FN2OS MolecularWeight: 386.525983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(CC(=O)NCCC2=CC=CC=C2)SCC3=CC=C(C=C3)F

Isomeric SMILES

C1CC(NC1)C(CC(=O)NCCC2=CC=CC=C2)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2OS/c23-19-10-8-18(9-11-19)16-27-21(20-7-4-13-24-20)15-22(26)25-14-12-17-5-2-1-3-6-17/h1-3,5-6,8-11,20-21,24H,4,7,12-16H2,(H,25,26)