4-[4-(5-fluoranyl-4,6-dimorpholin-4-yl-pyrimidin-2-yl)piperazin-1-yl]phenol

Systemtic Name: 4-[4-(5-fluoranyl-4,6-dimorpholin-4-yl-pyrimidin-2-yl)piperazin-1-yl]phenol Openeye Name: 4-[4-(5-fluoro-4,6-dimorpholino-pyrimidin-2-yl)piperazin-1-yl]phenol CAS Name: 4-[4-[5-fluoro-4,6-bis(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl]phenol IUPAC Name: 4-[4-(5-fluoro-4,6-dimorpholin-4-ylpyrimidin-2-yl)piperazin-1-yl]phenol Traditional Name: 4-[4-(5-fluoro-4,6-dimorpholino-pyrimidin-2-yl)piperazino]phenol Formula: C22H29FN6O3 MolecularWeight: 444.502463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C3=NC(=C(C(=N3)N4CCOCC4)F)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C3=NC(=C(C(=N3)N4CCOCC4)F)N5CCOCC5

InChI

InChI=1S/C22H29FN6O3/c23-19-20(27-9-13-31-14-10-27)24-22(25-21(19)28-11-15-32-16-12-28)29-7-5-26(6-8-29)17-1-3-18(30)4-2-17/h1-4,30H,5-16H2