6-[(4-methoxyphenyl)methylsulfanyl]-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]hexanamide

Systemtic Name: 6-[(4-methoxyphenyl)methylsulfanyl]-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]hexanamide Openeye Name: 6-[(4-methoxyphenyl)methylsulfanyl]-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]hexanamide CAS Name: 6-[(4-methoxyphenyl)methylthio]-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]hexanamide IUPAC Name: 6-[(4-methoxyphenyl)methylsulfanyl]-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]hexanamide Traditional Name: 6-(p-anisylthio)-N-[3-[3-(piperidinomethyl)phenoxy]propyl]hexanamide Formula: C29H42N2O3S MolecularWeight: 498.72038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSCCCCCC(=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CSCCCCCC(=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C29H42N2O3S/c1-33-27-15-13-25(14-16-27)24-35-21-7-2-4-12-29(32)30-17-9-20-34-28-11-8-10-26(22-28)23-31-18-5-3-6-19-31/h8,10-11,13-16,22H,2-7,9,12,17-21,23-24H2,1H3,(H,30,32)