N-(4-azanylbutyl)-2-(5-bromanyl-1H-indol-3-yl)quinoline-4-carboxamide

Systemtic Name: N-(4-azanylbutyl)-2-(5-bromanyl-1H-indol-3-yl)quinoline-4-carboxamide Openeye Name: N-(4-aminobutyl)-2-(5-bromo-1H-indol-3-yl)quinoline-4-carboxamide CAS Name: N-(4-aminobutyl)-2-(5-bromo-1H-indol-3-yl)-4-quinolinecarboxamide IUPAC Name: N-(4-aminobutyl)-2-(5-bromo-1H-indol-3-yl)quinoline-4-carboxamide Traditional Name: N-(4-aminobutyl)-2-(5-bromo-1H-indol-3-yl)cinchoninamide Formula: C22H21BrN4O MolecularWeight: 437.33234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CNC4=C3C=C(C=C4)Br)C(=O)NCCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CNC4=C3C=C(C=C4)Br)C(=O)NCCCCN

InChI

InChI=1S/C22H21BrN4O/c23-14-7-8-19-16(11-14)18(13-26-19)21-12-17(22(28)25-10-4-3-9-24)15-5-1-2-6-20(15)27-21/h1-2,5-8,11-13,26H,3-4,9-10,24H2,(H,25,28)