N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-[2-[(3-chlorophenyl)methylthio]ethyl]-1-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-[(3-chlorobenzyl)thio]ethyl]-1-m-anisyl-isonipecotamide Formula: C23H29ClN2O2S MolecularWeight: 433.00656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H29ClN2O2S/c1-28-22-7-3-4-18(15-22)16-26-11-8-20(9-12-26)23(27)25-10-13-29-17-19-5-2-6-21(24)14-19/h2-7,14-15,20H,8-13,16-17H2,1H3,(H,25,27)