methyl 5-[[4-[(2-aminocarbonylcyclopentyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-1-benzofuran-2-carboxylate

Systemtic Name: methyl 5-[[4-[(2-aminocarbonylcyclopentyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-1-benzofuran-2-carboxylate Openeye Name: methyl 5-[[4-[(2-carbamoylcyclopentyl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzofuran-2-carboxylate CAS Name: 5-[[4-[(2-carbamoylcyclopentyl)amino]-5-fluoro-2-pyrimidinyl]amino]-2-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-carbamoylcyclopentyl)amino]-5-fluoropyrimidin-2-yl]amino]-1-benzofuran-2-carboxylate Traditional Name: 5-[[4-[(2-carbamoylcyclopentyl)amino]-5-fluoro-pyrimidin-2-yl]amino]coumarilic acid methyl ester Formula: C20H20FN5O4 MolecularWeight: 413.402303

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4CCCC4C(=O)N)F

Isomeric SMILES

COC(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4CCCC4C(=O)N)F

InChI

InChI=1S/C20H20FN5O4/c1-29-19(28)16-8-10-7-11(5-6-15(10)30-16)24-20-23-9-13(21)18(26-20)25-14-4-2-3-12(14)17(22)27/h5-9,12,14H,2-4H2,1H3,(H2,22,27)(H2,23,24,25,26)