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

Systemtic Name: N4-(2-chloranyl-5-methoxy-pyridin-3-yl)-N2-(3,5-dimorpholin-4-ylphenyl)-N4-methyl-pyrimidine-2,4-diamine Openeye Name: N4-(2-chloro-5-methoxy-3-pyridyl)-N2-(3,5-dimorpholinophenyl)-N4-methyl-pyrimidine-2,4-diamine CAS Name: N2-[3,5-bis(4-morpholinyl)phenyl]-N4-(2-chloro-5-methoxy-3-pyridinyl)-N4-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-(2-chloro-5-methoxypyridin-3-yl)-2-N-(3,5-dimorpholin-4-ylphenyl)-4-N-methylpyrimidine-2,4-diamine Traditional Name: (2-chloro-5-methoxy-3-pyridyl)-[2-(3,5-dimorpholinoanilino)pyrimidin-4-yl]-methyl-amine Formula: C25H30ClN7O3 MolecularWeight: 512.0038

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=NC=C1)NC2=CC(=CC(=C2)N3CCOCC3)N4CCOCC4)C5=CC(=CN=C5Cl)OC

Isomeric SMILES

CN(C1=NC(=NC=C1)NC2=CC(=CC(=C2)N3CCOCC3)N4CCOCC4)C5=CC(=CN=C5Cl)OC

InChI

InChI=1S/C25H30ClN7O3/c1-31(22-16-21(34-2)17-28-24(22)26)23-3-4-27-25(30-23)29-18-13-19(32-5-9-35-10-6-32)15-20(14-18)33-7-11-36-12-8-33/h3-4,13-17H,5-12H2,1-2H3,(H,27,29,30)