6-(5-bromanylquinolin-8-yl)oxy-N4-(2-ethylphenyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(5-bromanylquinolin-8-yl)oxy-N4-(2-ethylphenyl)pyrimidine-4,5-diamine Openeye Name: 6-[(5-bromo-8-quinolyl)oxy]-N4-(2-ethylphenyl)pyrimidine-4,5-diamine CAS Name: 6-[(5-bromo-8-quinolinyl)oxy]-N4-(2-ethylphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(5-bromoquinolin-8-yl)oxy-4-N-(2-ethylphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[(5-bromo-8-quinolyl)oxy]pyrimidin-4-yl]-(2-ethylphenyl)amine Formula: C21H18BrN5O MolecularWeight: 436.30452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)N

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)N

InChI

InChI=1S/C21H18BrN5O/c1-2-13-6-3-4-8-16(13)27-20-18(23)21(26-12-25-20)28-17-10-9-15(22)14-7-5-11-24-19(14)17/h3-12H,2,23H2,1H3,(H,25,26,27)