N6-(3-methoxyphenyl)-N4-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(3-methoxyphenyl)-N4-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(3-methoxyphenyl)-N4-(2-methyl-5-quinolyl)pyrimidine-4,5,6-triamine CAS Name: N6-(3-methoxyphenyl)-N4-(2-methyl-5-quinolinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(3-methoxyphenyl)-4-N-(2-methylquinolin-5-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(m-anisidino)pyrimidin-4-yl]-(2-methyl-5-quinolyl)amine Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=NC=NC(=C3N)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=NC=NC(=C3N)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C21H20N6O/c1-13-9-10-16-17(25-13)7-4-8-18(16)27-21-19(22)20(23-12-24-21)26-14-5-3-6-15(11-14)28-2/h3-12H,22H2,1-2H3,(H2,23,24,26,27)