N4-(3,5-dimethylphenyl)-N6-quinolin-8-yl-pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3,5-dimethylphenyl)-N6-quinolin-8-yl-pyrimidine-4,5,6-triamine Openeye Name: N4-(3,5-dimethylphenyl)-N6-(8-quinolyl)pyrimidine-4,5,6-triamine CAS Name: N4-(3,5-dimethylphenyl)-N6-(8-quinolinyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C21H20N6 MolecularWeight: 356.4237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C21H20N6/c1-13-9-14(2)11-16(10-13)26-20-18(22)21(25-12-24-20)27-17-7-3-5-15-6-4-8-23-19(15)17/h3-12H,22H2,1-2H3,(H2,24,25,26,27)