2-(2-chlorophenyl)-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]quinoline-4-carboxamide

Systemtic Name: 2-(2-chlorophenyl)-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]quinoline-4-carboxamide Openeye Name: 2-(2-chlorophenyl)-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]quinoline-4-carboxamide CAS Name: 2-(2-chlorophenyl)-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-chlorophenyl)-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]quinoline-4-carboxamide Traditional Name: 2-(2-chlorophenyl)-N-[[2-(trifluoromethyl)phenyl]thiocarbamoyl]cinchoninamide Formula: C24H15ClF3N3OS MolecularWeight: 485.90861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)NC(=S)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)NC(=S)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C24H15ClF3N3OS/c25-18-10-4-1-8-15(18)21-13-16(14-7-2-5-11-19(14)29-21)22(32)31-23(33)30-20-12-6-3-9-17(20)24(26,27)28/h1-13H,(H2,30,31,32,33)