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

Systemtic Name: N4-(3-morpholin-4-ylpropyl)-N2-(3-pyridin-3-ylphenyl)pyrimidine-2,4-diamine Openeye Name: N4-(3-morpholinopropyl)-N2-[3-(3-pyridyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-[3-(4-morpholinyl)propyl]-N2-[3-(3-pyridinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-morpholin-4-ylpropyl)-2-N-(3-pyridin-3-ylphenyl)pyrimidine-2,4-diamine Traditional Name: 3-morpholinopropyl-[2-[3-(3-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=CN=CC=C4

Isomeric SMILES

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

InChI

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