N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(2,6-dimorpholin-4-ylpyridin-4-yl)pyrimidine-2,4-diamine

Systemtic Name: N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(2,6-dimorpholin-4-ylpyridin-4-yl)pyrimidine-2,4-diamine Openeye Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2,6-dimorpholino-4-pyridyl)pyrimidine-2,4-diamine CAS Name: N2-[2,6-bis(4-morpholinyl)-4-pyridinyl]-N4-(5-chloro-1,3-benzodioxol-4-yl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(5-chloro-1,3-benzodioxol-4-yl)-2-N-(2,6-dimorpholin-4-ylpyridin-4-yl)pyrimidine-2,4-diamine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[2-[(2,6-dimorpholino-4-pyridyl)amino]pyrimidin-4-yl]amine Formula: C24H26ClN7O4 MolecularWeight: 511.96074

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=CC(=N2)N3CCOCC3)NC4=NC=CC(=N4)NC5=C(C=CC6=C5OCO6)Cl

Isomeric SMILES

C1COCCN1C2=CC(=CC(=N2)N3CCOCC3)NC4=NC=CC(=N4)NC5=C(C=CC6=C5OCO6)Cl

InChI

InChI=1S/C24H26ClN7O4/c25-17-1-2-18-23(36-15-35-18)22(17)28-19-3-4-26-24(29-19)27-16-13-20(31-5-9-33-10-6-31)30-21(14-16)32-7-11-34-12-8-32/h1-4,13-14H,5-12,15H2,(H2,26,27,28,29,30)