2-[(4-bromophenyl)methylsulfanyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-[(4-bromophenyl)methylthio]-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[(4-bromobenzyl)thio]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=O)CSCC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=O)CSCC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN2O2S/c21-16-9-7-15(8-10-16)13-26-14-19(24)22-18-6-2-1-5-17(18)20(25)23-11-3-4-12-23/h1-2,5-10H,3-4,11-14H2,(H,22,24)