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

Systemtic Name: 3-bromanyl-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-4-fluoranyl-benzamide Openeye Name: 3-bromo-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-4-fluoro-benzamide CAS Name: 3-bromo-N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]cyclohexyl]-4-fluorobenzamide IUPAC Name: 3-bromo-N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclohexyl]-4-fluorobenzamide Traditional Name: 3-bromo-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-4-fluoro-benzamide Formula: C20H25BrFN5O MolecularWeight: 450.347803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Br

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C20H25BrFN5O/c1-12-23-18(11-19(24-12)27(2)3)25-14-5-7-15(8-6-14)26-20(28)13-4-9-17(22)16(21)10-13/h4,9-11,14-15H,5-8H2,1-3H3,(H,26,28)(H,23,24,25)