ethyl 5-[[2-[(2-ethoxycarbonyl-1-benzofuran-5-yl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-[[2-[(2-ethoxycarbonyl-1-benzofuran-5-yl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[[2-[(2-ethoxycarbonylbenzofuran-5-yl)amino]-5-fluoro-pyrimidin-4-yl]amino]benzofuran-2-carboxylate CAS Name: 5-[[2-[(2-ethoxycarbonyl-5-benzofuranyl)amino]-5-fluoro-4-pyrimidinyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[(2-ethoxycarbonyl-1-benzofuran-5-yl)amino]-5-fluoropyrimidin-4-yl]amino]-1-benzofuran-2-carboxylate Traditional Name: 5-[[2-[(2-carbethoxybenzofuran-5-yl)amino]-5-fluoro-pyrimidin-4-yl]amino]coumarilic acid ethyl ester Formula: C26H21FN4O6 MolecularWeight: 504.466543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)OC(=C5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)OC(=C5)C(=O)OCC

InChI

InChI=1S/C26H21FN4O6/c1-3-34-24(32)21-11-14-9-16(5-7-19(14)36-21)29-23-18(27)13-28-26(31-23)30-17-6-8-20-15(10-17)12-22(37-20)25(33)35-4-2/h5-13H,3-4H2,1-2H3,(H2,28,29,30,31)