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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)CSCC2=CC(=CC=C2)Cl)N3CCCC3

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)CSCC2=CC(=CC=C2)Cl)N3CCCC3

InChI

InChI=1S/C22H27ClN2O2S/c1-27-21-10-3-2-9-19(21)20(25-11-4-5-12-25)14-24-22(26)16-28-15-17-7-6-8-18(23)13-17/h2-3,6-10,13,20H,4-5,11-12,14-16H2,1H3,(H,24,26)