N4-(3-morpholin-4-ylpropyl)-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-(3-morpholin-4-ylpropyl)-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine Openeye Name: N4-(3-morpholinopropyl)-N2-[3-(4-pyridyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-[3-(4-morpholinyl)propyl]-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-morpholin-4-ylpropyl)-2-N-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: 3-morpholinopropyl-[2-[3-(4-pyridyl)anilino]pyrimidin-4-yl]amine Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC=NC=C4

Isomeric SMILES

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC=NC=C4

InChI

InChI=1S/C22H26N6O/c1-3-19(18-5-9-23-10-6-18)17-20(4-1)26-22-25-11-7-21(27-22)24-8-2-12-28-13-15-29-16-14-28/h1,3-7,9-11,17H,2,8,12-16H2,(H2,24,25,26,27)