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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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