3-[1-(2-phenylsulfanylethanoyl)piperidin-3-yl]-N-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-[1-(2-phenylsulfanylethanoyl)piperidin-3-yl]-N-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-[1-(2-phenylsulfanylacetyl)-3-piperidyl]-N-[4-(trifluoromethyl)phenyl]propanamide CAS Name: 3-[1-[1-oxo-2-(phenylthio)ethyl]-3-piperidinyl]-N-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-[1-(2-phenylsulfanylacetyl)piperidin-3-yl]-N-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-[1-[2-(phenylthio)acetyl]-3-piperidyl]-N-[4-(trifluoromethyl)phenyl]propionamide Formula: C23H25F3N2O2S MolecularWeight: 450.51701

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H25F3N2O2S/c24-23(25,26)18-9-11-19(12-10-18)27-21(29)13-8-17-5-4-14-28(15-17)22(30)16-31-20-6-2-1-3-7-20/h1-3,6-7,9-12,17H,4-5,8,13-16H2,(H,27,29)