3-(acetamidomethylsulfanyl)-N-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(acetamidomethylsulfanyl)-N-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]propanamide Openeye Name: 3-(acetamidomethylsulfanyl)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]propanamide CAS Name: 3-(acetamidomethylthio)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]propanamide IUPAC Name: 3-(acetamidomethylsulfanyl)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]propanamide Traditional Name: 3-(acetamidomethylthio)-N-[3-fluoro-5-(trifluoromethyl)benzyl]propionamide Formula: C14H16F4N2O2S MolecularWeight: 352.347653

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCSCCC(=O)NCC1=CC(=CC(=C1)F)C(F)(F)F

Isomeric SMILES

CC(=O)NCSCCC(=O)NCC1=CC(=CC(=C1)F)C(F)(F)F

InChI

InChI=1S/C14H16F4N2O2S/c1-9(21)20-8-23-3-2-13(22)19-7-10-4-11(14(16,17)18)6-12(15)5-10/h4-6H,2-3,7-8H2,1H3,(H,19,22)(H,20,21)