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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(C1=CC=CC=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

Isomeric SMILES

CSC(C1=CC=CC=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

InChI

InChI=1S/C23H30N2O2S/c1-28-22(20-10-3-2-4-11-20)23(26)24-13-8-16-27-21-12-7-9-19(17-21)18-25-14-5-6-15-25/h2-4,7,9-12,17,22H,5-6,8,13-16,18H2,1H3,(H,24,26)