N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide

Systemtic Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide Openeye Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-1-(1-naphthylmethyl)piperidine-3-carboxamide CAS Name: N-[3-[(2-fluorophenyl)methylthio]propyl]-1-(1-naphthalenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide Traditional Name: N-[3-[(2-fluorobenzyl)thio]propyl]-1-(1-naphthylmethyl)nipecotamide Formula: C27H31FN2OS MolecularWeight: 450.611243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC3=CC=CC=C32)C(=O)NCCCSCC4=CC=CC=C4F

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC3=CC=CC=C32)C(=O)NCCCSCC4=CC=CC=C4F

InChI

InChI=1S/C27H31FN2OS/c28-26-14-4-2-9-24(26)20-32-17-7-15-29-27(31)23-12-6-16-30(19-23)18-22-11-5-10-21-8-1-3-13-25(21)22/h1-5,8-11,13-14,23H,6-7,12,15-20H2,(H,29,31)