N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[3,5-bis(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[3,5-bis(trifluoromethyl)phenyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C17H12F6N2OS MolecularWeight: 406.345399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H12F6N2OS/c18-16(19,20)11-7-12(17(21,22)23)9-13(8-11)24-15(27)25-14(26)6-10-4-2-1-3-5-10/h1-5,7-9H,6H2,(H2,24,25,26,27)