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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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