6-(5-bromanylquinolin-8-yl)oxy-N-butyl-N-methyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N-butyl-N-methyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N-butyl-N-methyl-5-nitro-pyrimidin-4-amine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N-butyl-N-methyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-N-butyl-N-methyl-5-nitropyrimidin-4-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-butyl-methyl-amine Formula: C18H18BrN5O3 MolecularWeight: 432.27122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C)C1=C(C(=NC=N1)OC2=C3C(=C(C=C2)Br)C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN5O3/c1-3-4-10-23(2)17-16(24(25)26)18(22-11-21-17)27-14-8-7-13(19)12-6-5-9-20-15(12)14/h5-9,11H,3-4,10H2,1-2H3