4-phenylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]butanamide

Systemtic Name: 4-phenylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]butanamide Openeye Name: 4-phenylsulfanyl-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]butanamide CAS Name: 4-(phenylthio)-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]butanamide IUPAC Name: 4-phenylsulfanyl-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]butanamide Traditional Name: 4-(phenylthio)-N-[3-[3-(piperidinomethyl)phenoxy]propyl]butyramide Formula: C25H34N2O2S MolecularWeight: 426.61466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C25H34N2O2S/c28-25(14-8-19-30-24-12-3-1-4-13-24)26-15-9-18-29-23-11-7-10-22(20-23)21-27-16-5-2-6-17-27/h1,3-4,7,10-13,20H,2,5-6,8-9,14-19,21H2,(H,26,28)