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

Systemtic Name: 5-[[4-[(3-chloranyl-4-methoxy-phenyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-[[4-(3-chloro-4-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-[[4-(3-chloro-4-methoxyanilino)-5-fluoro-2-pyrimidinyl]amino]-N-methyl-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-[[4-(3-chloro-4-methoxyanilino)-5-fluoropyrimidin-2-yl]amino]-N-methyl-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-[[4-(3-chloro-4-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]-N-methyl-coumaran-2-carboxamide Formula: C21H19ClFN5O3 MolecularWeight: 443.858663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClFN5O3/c1-24-20(29)18-8-11-7-12(3-5-16(11)31-18)27-21-25-10-15(23)19(28-21)26-13-4-6-17(30-2)14(22)9-13/h3-7,9-10,18H,8H2,1-2H3,(H,24,29)(H2,25,26,27,28)