5-[[4-[(2,6-dimethoxypyridin-3-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 5-[[4-[(2,6-dimethoxypyridin-3-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-[[4-[(2,6-dimethoxy-3-pyridyl)amino]-5-fluoro-pyrimidin-2-yl]amino]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-[[4-[(2,6-dimethoxy-3-pyridinyl)amino]-5-fluoro-2-pyrimidinyl]amino]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-[[4-[(2,6-dimethoxypyridin-3-yl)amino]-5-fluoropyrimidin-2-yl]amino]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-[[4-[(2,6-dimethoxy-3-pyridyl)amino]-5-fluoro-pyrimidin-2-yl]amino]-N-methyl-coumaran-2-carboxamide Formula: C21H21FN6O4 MolecularWeight: 440.427643

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4=C(N=C(C=C4)OC)OC)F

Isomeric SMILES

CNC(=O)C1CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4=C(N=C(C=C4)OC)OC)F

InChI

InChI=1S/C21H21FN6O4/c1-23-19(29)16-9-11-8-12(4-6-15(11)32-16)25-21-24-10-13(22)18(28-21)26-14-5-7-17(30-2)27-20(14)31-3/h4-8,10,16H,9H2,1-3H3,(H,23,29)(H2,24,25,26,28)