3-chloranyl-4-fluoranyl-N-[4-[(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)amino]cyclohexyl]benzamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[4-[(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)amino]cyclohexyl]benzamide Openeye Name: 3-chloro-4-fluoro-N-[4-[(2-methyl-6-morpholino-pyrimidin-4-yl)amino]cyclohexyl]benzamide CAS Name: 3-chloro-4-fluoro-N-[4-[[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino]cyclohexyl]benzamide IUPAC Name: 3-chloro-4-fluoro-N-[4-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]cyclohexyl]benzamide Traditional Name: 3-chloro-4-fluoro-N-[4-[(2-methyl-6-morpholino-pyrimidin-4-yl)amino]cyclohexyl]benzamide Formula: C22H27ClFN5O2 MolecularWeight: 447.933483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Cl)N4CCOCC4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Cl)N4CCOCC4

InChI

InChI=1S/C22H27ClFN5O2/c1-14-25-20(13-21(26-14)29-8-10-31-11-9-29)27-16-3-5-17(6-4-16)28-22(30)15-2-7-19(24)18(23)12-15/h2,7,12-13,16-17H,3-6,8-11H2,1H3,(H,28,30)(H,25,26,27)