2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]ethanamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]acetamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]acetamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]acetamide Formula: C22H27ClN2O2S MolecularWeight: 418.97998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CSCC2=CC(=CC=C2)Cl)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CSCC2=CC(=CC=C2)Cl)N3CCCC3

InChI

InChI=1S/C22H27ClN2O2S/c1-27-20-9-5-7-18(13-20)21(25-10-2-3-11-25)14-24-22(26)16-28-15-17-6-4-8-19(23)12-17/h4-9,12-13,21H,2-3,10-11,14-16H2,1H3,(H,24,26)