6-(5-bromanylquinolin-8-yl)oxy-5-nitro-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-5-nitro-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-5-nitro-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-5-nitro-N-[4-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-5-nitro-N-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C20H11BrF3N5O3 MolecularWeight: 506.23225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)C(F)(F)F)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)C(F)(F)F)Br

InChI

InChI=1S/C20H11BrF3N5O3/c21-14-7-8-15(16-13(14)2-1-9-25-16)32-19-17(29(30)31)18(26-10-27-19)28-12-5-3-11(4-6-12)20(22,23)24/h1-10H,(H,26,27,28)