2-azanyl-3-methyl-N-[4-(trifluoromethylsulfanyl)phenyl]pentanamide

Systemtic Name: 2-azanyl-3-methyl-N-[4-(trifluoromethylsulfanyl)phenyl]pentanamide Openeye Name: 2-amino-3-methyl-N-[4-(trifluoromethylsulfanyl)phenyl]pentanamide CAS Name: 2-amino-3-methyl-N-[4-(trifluoromethylthio)phenyl]pentanamide IUPAC Name: 2-amino-3-methyl-N-[4-(trifluoromethylsulfanyl)phenyl]pentanamide Traditional Name: 2-amino-3-methyl-N-[4-(trifluoromethylthio)phenyl]valeramide Formula: C13H17F3N2OS MolecularWeight: 306.34709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)SC(F)(F)F)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=C(C=C1)SC(F)(F)F)N

InChI

InChI=1S/C13H17F3N2OS/c1-3-8(2)11(17)12(19)18-9-4-6-10(7-5-9)20-13(14,15)16/h4-8,11H,3,17H2,1-2H3,(H,18,19)