N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]thiophene-2-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]thiophene-2-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]thiophene-2-carboxamide CAS Name: N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylthio]-2-thiophenecarboxamide IUPAC Name: N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]thiophene-2-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-3-[[3-(trifluoromethyl)benzyl]thio]thiophene-2-carboxamide Formula: C21H18F3NOS2 MolecularWeight: 421.49893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=C(C=CS2)SCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=C(C=CS2)SCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3NOS2/c1-13-5-3-6-14(2)18(13)25-20(26)19-17(9-10-27-19)28-12-15-7-4-8-16(11-15)21(22,23)24/h3-11H,12H2,1-2H3,(H,25,26)