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

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[2-(trifluoromethyl)phenyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[2-(trifluoromethyl)phenyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[[2-(trifluoromethyl)phenyl]thio]-4-quinolinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[2-(trifluoromethyl)phenyl]sulfanylquinoline-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-[[2-(trifluoromethyl)phenyl]thio]cinchoninamide Formula: C24H16ClF3N2OS MolecularWeight: 472.90985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=CC=C4C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=CC=C4C(F)(F)F)Cl

InChI

InChI=1S/C24H16ClF3N2OS/c25-19-10-4-1-7-15(19)14-29-23(31)17-13-22(30-20-11-5-2-8-16(17)20)32-21-12-6-3-9-18(21)24(26,27)28/h1-13H,14H2,(H,29,31)