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

Systemtic Name: 2-chloranyl-6-fluoranyl-N-[4-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 2-chloro-6-fluoro-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzamide CAS Name: 2-chloro-6-fluoro-N-[4-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-[4-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 2-chloro-6-fluoro-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzamide Formula: C22H21ClFN5O2 MolecularWeight: 441.885843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F)N4CCOCC4

InChI

InChI=1S/C22H21ClFN5O2/c1-14-13-19(29-9-11-31-12-10-29)28-22(25-14)27-16-7-5-15(6-8-16)26-21(30)20-17(23)3-2-4-18(20)24/h2-8,13H,9-12H2,1H3,(H,26,30)(H,25,27,28)