N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-8-fluoranyl-quinoline-4-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-8-fluoranyl-quinoline-4-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-8-fluoro-quinoline-4-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-8-fluoro-4-quinolinecarboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-8-fluoroquinoline-4-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-bromo-1H-indol-3-yl)-8-fluoro-cinchoninamide Formula: C26H26BrFN4O MolecularWeight: 509.413243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)C2=CC(=NC3=C2C=CC=C3F)C4=CNC5=C4C=C(C=C5)Br)CN

Isomeric SMILES

C1CC(CC(C1)CNC(=O)C2=CC(=NC3=C2C=CC=C3F)C4=CNC5=C4C=C(C=C5)Br)CN

InChI

InChI=1S/C26H26BrFN4O/c27-17-7-8-23-19(10-17)21(14-30-23)24-11-20(18-5-2-6-22(28)25(18)32-24)26(33)31-13-16-4-1-3-15(9-16)12-29/h2,5-8,10-11,14-16,30H,1,3-4,9,12-13,29H2,(H,31,33)