N-[2,4-bis(fluoranyl)phenyl]-4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanamide Openeye Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-N-(2,4-difluorophenyl)butanamide CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-N-(2,4-difluorophenyl)butanamide IUPAC Name: 4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)-N-(2,4-difluorophenyl)butanamide Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-N-(2,4-difluorophenyl)butyramide Formula: C27H20ClF2N3O MolecularWeight: 475.917006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=C(N3)C=CC(=C4)Cl)CCCC(=O)NC5=C(C=C(C=C5)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=C(N3)C=CC(=C4)Cl)CCCC(=O)NC5=C(C=C(C=C5)F)F

InChI

InChI=1S/C27H20ClF2N3O/c28-17-9-12-23-20(14-17)19(5-3-7-26(34)32-24-13-10-18(29)15-21(24)30)27(33-23)25-11-8-16-4-1-2-6-22(16)31-25/h1-2,4,6,8-15,33H,3,5,7H2,(H,32,34)