6-(5-bromanylquinolin-8-yl)oxy-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N4-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N4-(3-pyridylmethyl)pyrimidine-4,5-diamine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N4-(3-pyridinylmethyl)pyrimidine-4,5-diamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[(5-bromo-8-quinolyl)oxy]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C19H15BrN6O MolecularWeight: 423.266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)N

InChI

InChI=1S/C19H15BrN6O/c20-14-5-6-15(17-13(14)4-2-8-23-17)27-19-16(21)18(25-11-26-19)24-10-12-3-1-7-22-9-12/h1-9,11H,10,21H2,(H,24,25,26)