N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-6-sulfanyl-hexanamide

Systemtic Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-6-sulfanyl-hexanamide Openeye Name: N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-6-sulfanyl-hexanamide CAS Name: 6-mercapto-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]hexanamide IUPAC Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-6-sulfanylhexanamide Traditional Name: 6-mercapto-N-[3-[3-(piperidinomethyl)phenoxy]propyl]hexanamide Formula: C21H34N2O2S MolecularWeight: 378.57186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCCCS

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CCCCCS

InChI

InChI=1S/C21H34N2O2S/c24-21(11-3-1-6-16-26)22-12-8-15-25-20-10-7-9-19(17-20)18-23-13-4-2-5-14-23/h7,9-10,17,26H,1-6,8,11-16,18H2,(H,22,24)