2-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-cyclohexyl-quinoline-4-carboxamide

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-cyclohexyl-quinoline-4-carboxamide Openeye Name: N-cyclohexyl-2-(2,4-difluorophenyl)sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclohexyl-2-[(2,4-difluorophenyl)thio]-4-quinolinecarboxamide IUPAC Name: N-cyclohexyl-2-(2,4-difluorophenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-cyclohexyl-2-[(2,4-difluorophenyl)thio]cinchoninamide Formula: C22H20F2N2OS MolecularWeight: 398.468806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C22H20F2N2OS/c23-14-10-11-20(18(24)12-14)28-21-13-17(16-8-4-5-9-19(16)26-21)22(27)25-15-6-2-1-3-7-15/h4-5,8-13,15H,1-3,6-7H2,(H,25,27)