6-[[2-[(3,4-dimethoxy-5-oxidanyl-phenyl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[2-[(3,4-dimethoxy-5-oxidanyl-phenyl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[5-fluoro-2-(3-hydroxy-4,5-dimethoxy-anilino)pyrimidin-4-yl]amino]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[5-fluoro-2-(3-hydroxy-4,5-dimethoxyanilino)-4-pyrimidinyl]amino]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[5-fluoro-2-(3-hydroxy-4,5-dimethoxyanilino)pyrimidin-4-yl]amino]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[5-fluoro-2-(3-hydroxy-4,5-dimethoxy-anilino)pyrimidin-4-yl]amino]-4H-1,4-benzoxazin-3-one Formula: C20H18FN5O5 MolecularWeight: 427.385823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)O)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)OCC(=O)N4)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)O)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)OCC(=O)N4)F

InChI

InChI=1S/C20H18FN5O5/c1-29-16-7-11(6-14(27)18(16)30-2)24-20-22-8-12(21)19(26-20)23-10-3-4-15-13(5-10)25-17(28)9-31-15/h3-8,27H,9H2,1-2H3,(H,25,28)(H2,22,23,24,26)