2-[[2-[5-(5-fluoranyl-1-benzofuran-2-yl)pyridin-3-yl]-6-propyl-pyrimidin-4-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[5-(5-fluoranyl-1-benzofuran-2-yl)pyridin-3-yl]-6-propyl-pyrimidin-4-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[5-(5-fluorobenzofuran-2-yl)-3-pyridyl]-6-propyl-pyrimidin-4-yl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[5-(5-fluoro-2-benzofuranyl)-3-pyridinyl]-6-propyl-4-pyrimidinyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[5-(5-fluoro-1-benzofuran-2-yl)pyridin-3-yl]-6-propylpyrimidin-4-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[5-(5-fluorobenzofuran-2-yl)-3-pyridyl]-6-propyl-pyrimidin-4-yl]amino]-4-methyl-valeric acid Formula: C26H27FN4O3 MolecularWeight: 462.515983

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)C2=CN=CC(=C2)C3=CC4=C(O3)C=CC(=C4)F)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCC1=CC(=NC(=N1)C2=CN=CC(=C2)C3=CC4=C(O3)C=CC(=C4)F)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C26H27FN4O3/c1-4-5-20-12-24(30-21(26(32)33)8-15(2)3)31-25(29-20)18-9-17(13-28-14-18)23-11-16-10-19(27)6-7-22(16)34-23/h6-7,9-15,21H,4-5,8H2,1-3H3,(H,32,33)(H,29,30,31)