2-[3,3-bis(fluoranyl)azetidin-1-yl]-4-cyclobutyl-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[3,3-bis(fluoranyl)azetidin-1-yl]-4-cyclobutyl-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide Openeye Name: 4-cyclobutyl-2-(3,3-difluoroazetidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide CAS Name: 4-cyclobutyl-2-(3,3-difluoro-1-azetidinyl)-N-(5-hydroxy-2-adamantyl)-5-pyrimidinecarboxamide IUPAC Name: 4-cyclobutyl-2-(3,3-difluoroazetidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide Traditional Name: 4-cyclobutyl-2-(3,3-difluoroazetidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide Formula: C22H28F2N4O2 MolecularWeight: 418.480126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=NC(=NC=C2C(=O)NC3C4CC5CC3CC(C5)(C4)O)N6CC(C6)(F)F

Isomeric SMILES

C1CC(C1)C2=NC(=NC=C2C(=O)NC3C4CC5CC3CC(C5)(C4)O)N6CC(C6)(F)F

InChI

InChI=1S/C22H28F2N4O2/c23-22(24)10-28(11-22)20-25-9-16(18(27-20)13-2-1-3-13)19(29)26-17-14-4-12-5-15(17)8-21(30,6-12)7-14/h9,12-15,17,30H,1-8,10-11H2,(H,26,29)