5-[[5-fluoranyl-4-[(3-hydroxyphenyl)amino]pyrimidin-2-yl]amino]-N,N-dimethyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-[[5-fluoranyl-4-[(3-hydroxyphenyl)amino]pyrimidin-2-yl]amino]-N,N-dimethyl-1-benzofuran-2-carboxamide Openeye Name: 5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]-N,N-dimethyl-benzofuran-2-carboxamide CAS Name: 5-[[5-fluoro-4-(3-hydroxyanilino)-2-pyrimidinyl]amino]-N,N-dimethyl-2-benzofurancarboxamide IUPAC Name: 5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]-N,N-dimethyl-1-benzofuran-2-carboxamide Traditional Name: 5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]-N,N-dimethyl-coumarilamide Formula: C21H18FN5O3 MolecularWeight: 407.397723

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)O)F

Isomeric SMILES

CN(C)C(=O)C1=CC2=C(O1)C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)O)F

InChI

InChI=1S/C21H18FN5O3/c1-27(2)20(29)18-9-12-8-14(6-7-17(12)30-18)25-21-23-11-16(22)19(26-21)24-13-4-3-5-15(28)10-13/h3-11,28H,1-2H3,(H2,23,24,25,26)