3,4,5-tris(fluoranyl)-N-[4-[(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide

Systemtic Name: 3,4,5-tris(fluoranyl)-N-[4-[(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Openeye Name: 3,4,5-trifluoro-N-[4-[(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide CAS Name: 3,4,5-trifluoro-N-[4-[(7-methyl-4-pyrrolo[2,3-d]pyrimidinyl)amino]cyclohexyl]benzamide IUPAC Name: 3,4,5-trifluoro-N-[4-[(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Traditional Name: 3,4,5-trifluoro-N-[4-[(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Formula: C20H20F3N5O MolecularWeight: 403.40091

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1N=CN=C2NC3CCC(CC3)NC(=O)C4=CC(=C(C(=C4)F)F)F

Isomeric SMILES

CN1C=CC2=C1N=CN=C2NC3CCC(CC3)NC(=O)C4=CC(=C(C(=C4)F)F)F

InChI

InChI=1S/C20H20F3N5O/c1-28-7-6-14-18(24-10-25-19(14)28)26-12-2-4-13(5-3-12)27-20(29)11-8-15(21)17(23)16(22)9-11/h6-10,12-13H,2-5H2,1H3,(H,27,29)(H,24,25,26)