2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoranyl-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoranyl-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoro-7-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoro-7-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoro-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[[(2R)-5-fluoro-7-(5-pyrimidyl)coumaran-2-yl]methyl]acetamide Formula: C22H18FN3O4 MolecularWeight: 407.394423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2C3=CN=CN=C3)F)CNC(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1[C@@H](OC2=C1C=C(C=C2C3=CN=CN=C3)F)CNC(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18FN3O4/c23-16-5-14-6-17(30-22(14)18(7-16)15-8-24-11-25-9-15)10-26-21(27)4-13-1-2-19-20(3-13)29-12-28-19/h1-3,5,7-9,11,17H,4,6,10,12H2,(H,26,27)/t17-/m1/s1