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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)N(C)CC4=CC=CC=C4)N

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)N(C)CC4=CC=CC=C4)N

InChI

InChI=1S/C22H22N6/c1-15-11-12-17-18(26-15)9-6-10-19(17)27-21-20(23)22(25-14-24-21)28(2)13-16-7-4-3-5-8-16/h3-12,14H,13,23H2,1-2H3,(H,24,25,27)