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

Systemtic Name: 6-(3,5-dimethylphenoxy)-N4-quinolin-8-yl-pyrimidine-4,5-diamine Openeye Name: 6-(3,5-dimethylphenoxy)-N4-(8-quinolyl)pyrimidine-4,5-diamine CAS Name: 6-(3,5-dimethylphenoxy)-N4-(8-quinolinyl)pyrimidine-4,5-diamine IUPAC Name: 6-(3,5-dimethylphenoxy)-4-N-quinolin-8-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C21H19N5O/c1-13-9-14(2)11-16(10-13)27-21-18(22)20(24-12-25-21)26-17-7-3-5-15-6-4-8-23-19(15)17/h3-12H,22H2,1-2H3,(H,24,25,26)