6-bromanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-(2-ketopyrrolidino)propyl]-2-(2-pyridyl)cinchoninamide Formula: C22H21BrN4O2 MolecularWeight: 453.33174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=N4

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=N4

InChI

InChI=1S/C22H21BrN4O2/c23-15-7-8-18-16(13-15)17(14-20(26-18)19-5-1-2-9-24-19)22(29)25-10-4-12-27-11-3-6-21(27)28/h1-2,5,7-9,13-14H,3-4,6,10-12H2,(H,25,29)