N4-(2,5-dimethylphenyl)-N2-(3,5-dimorpholin-4-ylphenyl)-N4-methyl-pyrimidine-2,4-diamine

Systemtic Name: N4-(2,5-dimethylphenyl)-N2-(3,5-dimorpholin-4-ylphenyl)-N4-methyl-pyrimidine-2,4-diamine Openeye Name: N4-(2,5-dimethylphenyl)-N2-(3,5-dimorpholinophenyl)-N4-methyl-pyrimidine-2,4-diamine CAS Name: N2-[3,5-bis(4-morpholinyl)phenyl]-N4-(2,5-dimethylphenyl)-N4-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-(2,5-dimethylphenyl)-2-N-(3,5-dimorpholin-4-ylphenyl)-4-N-methylpyrimidine-2,4-diamine Traditional Name: (2,5-dimethylphenyl)-[2-(3,5-dimorpholinoanilino)pyrimidin-4-yl]-methyl-amine Formula: C27H34N6O2 MolecularWeight: 474.59786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C)C2=NC(=NC=C2)NC3=CC(=CC(=C3)N4CCOCC4)N5CCOCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C)C2=NC(=NC=C2)NC3=CC(=CC(=C3)N4CCOCC4)N5CCOCC5

InChI

InChI=1S/C27H34N6O2/c1-20-4-5-21(2)25(16-20)31(3)26-6-7-28-27(30-26)29-22-17-23(32-8-12-34-13-9-32)19-24(18-22)33-10-14-35-15-11-33/h4-7,16-19H,8-15H2,1-3H3,(H,28,29,30)