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

Systemtic Name: N6-(4-ethylphenyl)-N4-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-ethylphenyl)-N4-(2-methyl-5-quinolyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-ethylphenyl)-N4-(2-methyl-5-quinolinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-ethylphenyl)-4-N-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-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=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC4=C3C=CC(=N4)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC4=C3C=CC(=N4)C)N

InChI

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