[4-(trifluoromethyl)phenyl]methyl (2S)-2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl (2S)-2-benzamido-4-methylsulfanyl-butanoate Openeye Name: [4-(trifluoromethyl)phenyl]methyl (2S)-2-benzamido-4-methylsulfanyl-butanoate CAS Name: (2S)-2-benzamido-4-(methylthio)butanoic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl (2S)-2-benzamido-4-methylsulfanylbutanoate Traditional Name: (2S)-2-benzamido-4-(methylthio)butyric acid [4-(trifluoromethyl)benzyl] ester Formula: C20H20F3NO3S MolecularWeight: 411.43791

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC1=CC=C(C=C1)C(F)(F)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)OCC1=CC=C(C=C1)C(F)(F)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20F3NO3S/c1-28-12-11-17(24-18(25)15-5-3-2-4-6-15)19(26)27-13-14-7-9-16(10-8-14)20(21,22)23/h2-10,17H,11-13H2,1H3,(H,24,25)/t17-/m0/s1