2-naphthalen-2-ylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanamide

Systemtic Name: 2-naphthalen-2-ylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanamide Openeye Name: 2-(2-naphthylsulfanyl)-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]acetamide CAS Name: 2-(2-naphthalenylthio)-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]acetamide IUPAC Name: 2-naphthalen-2-ylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide Traditional Name: 2-(2-naphthylthio)-N-[3-[3-(piperidinomethyl)phenoxy]propyl]acetamide Formula: C27H32N2O2S MolecularWeight: 448.62018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H32N2O2S/c30-27(21-32-26-13-12-23-9-2-3-10-24(23)19-26)28-14-7-17-31-25-11-6-8-22(18-25)20-29-15-4-1-5-16-29/h2-3,6,8-13,18-19H,1,4-5,7,14-17,20-21H2,(H,28,30)