[3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenyl] butanoate

Systemtic Name: [3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenyl] butanoate Openeye Name: [3-[2-morpholino-6-(3-pyridylamino)pyrimidin-4-yl]phenyl] butanoate CAS Name: butanoic acid [3-[2-(4-morpholinyl)-6-(3-pyridinylamino)-4-pyrimidinyl]phenyl] ester IUPAC Name: [3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenyl] butanoate Traditional Name: butyric acid [3-[2-morpholino-6-(3-pyridylamino)pyrimidin-4-yl]phenyl] ester Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=CC(=C1)C2=CC(=NC(=N2)N3CCOCC3)NC4=CN=CC=C4

Isomeric SMILES

CCCC(=O)OC1=CC=CC(=C1)C2=CC(=NC(=N2)N3CCOCC3)NC4=CN=CC=C4

InChI

InChI=1S/C23H25N5O3/c1-2-5-22(29)31-19-8-3-6-17(14-19)20-15-21(25-18-7-4-9-24-16-18)27-23(26-20)28-10-12-30-13-11-28/h3-4,6-9,14-16H,2,5,10-13H2,1H3,(H,25,26,27)