6-(5-bromanylquinolin-8-yl)oxy-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N-[3-(1-imidazolyl)propyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-N-(3-imidazol-1-ylpropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-(3-imidazol-1-ylpropyl)amine Formula: C19H16BrN7O3 MolecularWeight: 470.27944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NCCCN4C=CN=C4)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NCCCN4C=CN=C4)Br

InChI

InChI=1S/C19H16BrN7O3/c20-14-4-5-15(16-13(14)3-1-6-22-16)30-19-17(27(28)29)18(24-11-25-19)23-7-2-9-26-10-8-21-12-26/h1,3-6,8,10-12H,2,7,9H2,(H,23,24,25)