N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromanyl-1H-indol-3-yl)-6-(trifluoromethyl)quinoline-4-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromanyl-1H-indol-3-yl)-6-(trifluoromethyl)quinoline-4-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromo-1H-indol-3-yl)-6-(trifluoromethyl)quinoline-4-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromo-1H-indol-3-yl)-6-(trifluoromethyl)-4-quinolinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromo-1H-indol-3-yl)-6-(trifluoromethyl)quinoline-4-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-(5-bromo-1H-indol-3-yl)-6-(trifluoromethyl)cinchoninamide Formula: C27H17BrF3N5O MolecularWeight: 564.35599

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC(=O)C3=CC(=NC4=C3C=C(C=C4)C(F)(F)F)C5=CNC6=C5C=C(C=C6)Br

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC(=O)C3=CC(=NC4=C3C=C(C=C4)C(F)(F)F)C5=CNC6=C5C=C(C=C6)Br

InChI

InChI=1S/C27H17BrF3N5O/c28-15-6-8-20-17(10-15)19(12-32-20)24-11-18(16-9-14(27(29,30)31)5-7-21(16)34-24)26(37)33-13-25-35-22-3-1-2-4-23(22)36-25/h1-12,32H,13H2,(H,33,37)(H,35,36)