1-[(3-ethoxyphenyl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-ethoxyphenyl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]piperidine-4-carboxamide Openeye Name: 1-[(3-ethoxyphenyl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]piperidine-4-carboxamide CAS Name: 1-[(3-ethoxyphenyl)methyl]-N-[3-[(2-fluorophenyl)methylthio]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-ethoxyphenyl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]piperidine-4-carboxamide Traditional Name: 1-(3-ethoxybenzyl)-N-[3-[(2-fluorobenzyl)thio]propyl]isonipecotamide Formula: C25H33FN2O2S MolecularWeight: 444.605123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCCSCC3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NCCCSCC3=CC=CC=C3F

InChI

InChI=1S/C25H33FN2O2S/c1-2-30-23-9-5-7-20(17-23)18-28-14-11-21(12-15-28)25(29)27-13-6-16-31-19-22-8-3-4-10-24(22)26/h3-5,7-10,17,21H,2,6,11-16,18-19H2,1H3,(H,27,29)