4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-[[4-(trifluoromethyloxy)phenyl]methyl]butanamide

Systemtic Name: 4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-[[4-(trifluoromethyloxy)phenyl]methyl]butanamide Openeye Name: 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-[[4-(trifluoromethoxy)phenyl]methyl]butanamide CAS Name: 4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-[[4-(trifluoromethoxy)phenyl]methyl]butanamide IUPAC Name: 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-[[4-(trifluoromethoxy)phenyl]methyl]butanamide Traditional Name: 4-(methylthio)-2-[(2-phenoxyacetyl)amino]-N-[4-(trifluoromethoxy)benzyl]butyramide Formula: C21H23F3N2O4S MolecularWeight: 456.47853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=C(C=C1)OC(F)(F)F)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)NCC1=CC=C(C=C1)OC(F)(F)F)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H23F3N2O4S/c1-31-12-11-18(26-19(27)14-29-16-5-3-2-4-6-16)20(28)25-13-15-7-9-17(10-8-15)30-21(22,23)24/h2-10,18H,11-14H2,1H3,(H,25,28)(H,26,27)