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

Systemtic Name: [3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenyl] dihydrogen phosphate Openeye Name: [3-[2-morpholino-6-(3-pyridylamino)pyrimidin-4-yl]phenyl] dihydrogen phosphate CAS Name: [3-[2-(4-morpholinyl)-6-(3-pyridinylamino)-4-pyrimidinyl]phenyl] dihydrogen phosphate IUPAC Name: [3-[2-morpholin-4-yl-6-(pyridin-3-ylamino)pyrimidin-4-yl]phenyl] dihydrogen phosphate Traditional Name: [3-[2-morpholino-6-(3-pyridylamino)pyrimidin-4-yl]phenyl] dihydrogen phosphate Formula: C19H20N5O5P MolecularWeight: 429.366361

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CC(=N2)NC3=CN=CC=C3)C4=CC(=CC=C4)OP(=O)(O)O

Isomeric SMILES

C1COCCN1C2=NC(=CC(=N2)NC3=CN=CC=C3)C4=CC(=CC=C4)OP(=O)(O)O

InChI

InChI=1S/C19H20N5O5P/c25-30(26,27)29-16-5-1-3-14(11-16)17-12-18(21-15-4-2-6-20-13-15)23-19(22-17)24-7-9-28-10-8-24/h1-6,11-13H,7-10H2,(H,21,22,23)(H2,25,26,27)