N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethoxy)phenyl]methylthio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[4-(trifluoromethoxy)benzyl]thio]butyramide Formula: C20H22F3NO2S MolecularWeight: 397.45439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C20H22F3NO2S/c1-14-5-3-6-15(2)19(14)24-18(25)7-4-12-27-13-16-8-10-17(11-9-16)26-20(21,22)23/h3,5-6,8-11H,4,7,12-13H2,1-2H3,(H,24,25)