N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-1-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-1-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-benzyl-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide CAS Name: N-[2-[(3,4-dichlorophenyl)methylthio]ethyl]-1-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-benzyl-N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]piperidine-4-carboxamide Traditional Name: 1-benzyl-N-[2-[(3,4-dichlorobenzyl)thio]ethyl]isonipecotamide Formula: C22H26Cl2N2OS MolecularWeight: 437.42564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H26Cl2N2OS/c23-20-7-6-18(14-21(20)24)16-28-13-10-25-22(27)19-8-11-26(12-9-19)15-17-4-2-1-3-5-17/h1-7,14,19H,8-13,15-16H2,(H,25,27)