2-(phenylmethylsulfanyl)-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]ethanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]acetamide CAS Name: 2-(phenylmethylthio)-N-[3-[3-(1-pyrrolidinylmethyl)phenoxy]propyl]acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]acetamide Traditional Name: 2-(benzylthio)-N-[3-[3-(pyrrolidinomethyl)phenoxy]propyl]acetamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O2S/c26-23(19-28-18-20-8-2-1-3-9-20)24-12-7-15-27-22-11-6-10-21(16-22)17-25-13-4-5-14-25/h1-3,6,8-11,16H,4-5,7,12-15,17-19H2,(H,24,26)