N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]propanamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-(benzylthio)-N-[2-morpholino-5-(trifluoromethyl)phenyl]propionamide Formula: C21H23F3N2O2S MolecularWeight: 424.47973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)N2CCOCC2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)N2CCOCC2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H23F3N2O2S/c1-15(29-14-16-5-3-2-4-6-16)20(27)25-18-13-17(21(22,23)24)7-8-19(18)26-9-11-28-12-10-26/h2-8,13,15H,9-12,14H2,1H3,(H,25,27)