2-(4-acetamidophenyl)-N-[2,5-bis(fluoranyl)phenyl]-6-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-acetamidophenyl)-N-[2,5-bis(fluoranyl)phenyl]-6-methyl-quinoline-4-carboxamide Openeye Name: 2-(4-acetamidophenyl)-N-(2,5-difluorophenyl)-6-methyl-quinoline-4-carboxamide CAS Name: 2-(4-acetamidophenyl)-N-(2,5-difluorophenyl)-6-methyl-4-quinolinecarboxamide IUPAC Name: 2-(4-acetamidophenyl)-N-(2,5-difluorophenyl)-6-methylquinoline-4-carboxamide Traditional Name: 2-(4-acetamidophenyl)-N-(2,5-difluorophenyl)-6-methyl-cinchoninamide Formula: C25H19F2N3O2 MolecularWeight: 431.434066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=CC(=C3)F)F)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=CC(=C3)F)F)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C25H19F2N3O2/c1-14-3-10-22-19(11-14)20(25(32)30-24-12-17(26)6-9-21(24)27)13-23(29-22)16-4-7-18(8-5-16)28-15(2)31/h3-13H,1-2H3,(H,28,31)(H,30,32)