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

Systemtic Name: N2-(3,5-dimorpholin-4-ylphenyl)-N4-(5-methoxy-2-methyl-phenyl)-N4-methyl-pyrimidine-2,4-diamine Openeye Name: N2-(3,5-dimorpholinophenyl)-N4-(5-methoxy-2-methyl-phenyl)-N4-methyl-pyrimidine-2,4-diamine CAS Name: N2-[3,5-bis(4-morpholinyl)phenyl]-N4-(5-methoxy-2-methylphenyl)-N4-methylpyrimidine-2,4-diamine IUPAC Name: 2-N-(3,5-dimorpholin-4-ylphenyl)-4-N-(5-methoxy-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine Traditional Name: [2-(3,5-dimorpholinoanilino)pyrimidin-4-yl]-(5-methoxy-2-methyl-phenyl)-methyl-amine Formula: C27H34N6O3 MolecularWeight: 490.59726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N6O3/c1-20-4-5-24(34-3)19-25(20)31(2)26-6-7-28-27(30-26)29-21-16-22(32-8-12-35-13-9-32)18-23(17-21)33-10-14-36-15-11-33/h4-7,16-19H,8-15H2,1-3H3,(H,28,29,30)