N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-(pyridin-3-ylmethylsulfanyl)ethanamide

Systemtic Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-(pyridin-3-ylmethylsulfanyl)ethanamide Openeye Name: N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-2-(3-pyridylmethylsulfanyl)acetamide CAS Name: N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-2-(3-pyridinylmethylthio)acetamide IUPAC Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-2-(pyridin-3-ylmethylsulfanyl)acetamide Traditional Name: N-[3-[3-(piperidinomethyl)phenoxy]propyl]-2-(3-pyridylmethylthio)acetamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CSCC3=CN=CC=C3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CSCC3=CN=CC=C3

InChI

InChI=1S/C23H31N3O2S/c27-23(19-29-18-21-8-5-10-24-16-21)25-11-6-14-28-22-9-4-7-20(15-22)17-26-12-2-1-3-13-26/h4-5,7-10,15-16H,1-3,6,11-14,17-19H2,(H,25,27)