2-[(3-chlorophenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]acetamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-[4-(pyrrolidine-1-carbonyl)benzyl]acetamide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O2S/c22-19-5-3-4-17(12-19)14-27-15-20(25)23-13-16-6-8-18(9-7-16)21(26)24-10-1-2-11-24/h3-9,12H,1-2,10-11,13-15H2,(H,23,25)