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

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-1-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-[(4-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=C(C=C3)Cl

Isomeric SMILES

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

InChI

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