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

Systemtic Name: 6-bromanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[3-(2-ketopyrrolidino)propyl]-2-(4-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=NC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrN4O2/c23-16-4-5-19-17(13-16)18(14-20(26-19)15-6-9-24-10-7-15)22(29)25-8-2-12-27-11-1-3-21(27)28/h4-7,9-10,13-14H,1-3,8,11-12H2,(H,25,29)