6-bromanyl-N-(3-imidazol-1-ylpropyl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(3-imidazol-1-ylpropyl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-(3-imidazol-1-ylpropyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-(1-imidazolyl)propyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(3-imidazol-1-ylpropyl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-(3-imidazol-1-ylpropyl)-2-(3-pyridyl)cinchoninamide Formula: C21H18BrN5O MolecularWeight: 436.30452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C21H18BrN5O/c22-16-4-5-19-17(11-16)18(12-20(26-19)15-3-1-6-23-13-15)21(28)25-7-2-9-27-10-8-24-14-27/h1,3-6,8,10-14H,2,7,9H2,(H,25,28)