1-[(4-bromophenyl)methyl]-N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]piperidine-3-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]piperidine-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]piperidine-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[3-[(4-chlorophenyl)methylthio]propyl]-3-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]piperidine-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[3-[(4-chlorobenzyl)thio]propyl]nipecotamide Formula: C23H28BrClN2OS MolecularWeight: 495.90322

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)Br)C(=O)NCCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)Br)C(=O)NCCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28BrClN2OS/c24-21-8-4-18(5-9-21)15-27-13-1-3-20(16-27)23(28)26-12-2-14-29-17-19-6-10-22(25)11-7-19/h4-11,20H,1-3,12-17H2,(H,26,28)