6-(3,5-dimethylphenoxy)-N4-(2-methylquinolin-8-yl)pyrimidine-4,5-diamine

Systemtic Name: 6-(3,5-dimethylphenoxy)-N4-(2-methylquinolin-8-yl)pyrimidine-4,5-diamine Openeye Name: 6-(3,5-dimethylphenoxy)-N4-(2-methyl-8-quinolyl)pyrimidine-4,5-diamine CAS Name: 6-(3,5-dimethylphenoxy)-N4-(2-methyl-8-quinolinyl)pyrimidine-4,5-diamine IUPAC Name: 6-(3,5-dimethylphenoxy)-4-N-(2-methylquinolin-8-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-(2-methyl-8-quinolyl)amine Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)OC4=CC(=CC(=C4)C)C)N)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)OC4=CC(=CC(=C4)C)C)N)C=C1

InChI

InChI=1S/C22H21N5O/c1-13-9-14(2)11-17(10-13)28-22-19(23)21(24-12-25-22)27-18-6-4-5-16-8-7-15(3)26-20(16)18/h4-12H,23H2,1-3H3,(H,24,25,27)