N6-(2-ethylphenyl)-N4-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(2-ethylphenyl)-N4-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(2-ethylphenyl)-N4-(2-methyl-5-quinolyl)pyrimidine-4,5,6-triamine CAS Name: N6-(2-ethylphenyl)-N4-(2-methyl-5-quinolinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(2-ethylphenyl)-4-N-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2-ethylanilino)pyrimidin-4-yl]-(2-methyl-5-quinolyl)amine Formula: C22H22N6 MolecularWeight: 370.45028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC=CC4=C3C=CC(=N4)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC=CC4=C3C=CC(=N4)C

InChI

InChI=1S/C22H22N6/c1-3-15-7-4-5-8-17(15)27-21-20(23)22(25-13-24-21)28-19-10-6-9-18-16(19)12-11-14(2)26-18/h4-13H,3,23H2,1-2H3,(H2,24,25,27,28)