2-azanyl-3-methyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]pentanamide

Systemtic Name: 2-azanyl-3-methyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]pentanamide Openeye Name: 2-amino-3-methyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]pentanamide CAS Name: 2-amino-3-methyl-N-[2-(2,2,2-trifluoroethylthio)phenyl]pentanamide IUPAC Name: 2-amino-3-methyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]pentanamide Traditional Name: 2-amino-3-methyl-N-[2-(2,2,2-trifluoroethylthio)phenyl]valeramide Formula: C14H19F3N2OS MolecularWeight: 320.37367

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=CC=C1SCC(F)(F)F)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=CC=C1SCC(F)(F)F)N

InChI

InChI=1S/C14H19F3N2OS/c1-3-9(2)12(18)13(20)19-10-6-4-5-7-11(10)21-8-14(15,16)17/h4-7,9,12H,3,8,18H2,1-2H3,(H,19,20)