2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(trifluoromethyl)phenyl]cinchoninamide Formula: C24H15F3N4OS MolecularWeight: 464.46231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)SC3=NC4=CC=CC=C4N3)C(=O)NC5=CC=CC=C5C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)SC3=NC4=CC=CC=C4N3)C(=O)NC5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C24H15F3N4OS/c25-24(26,27)16-8-2-4-10-18(16)29-22(32)15-13-21(28-17-9-3-1-7-14(15)17)33-23-30-19-11-5-6-12-20(19)31-23/h1-13H,(H,29,32)(H,30,31)