3-[6-(2-fluoranyl-4-nitro-phenoxy)pyrimidin-4-yl]-1-methyl-1-(oxan-4-yl)urea

Systemtic Name: 3-[6-(2-fluoranyl-4-nitro-phenoxy)pyrimidin-4-yl]-1-methyl-1-(oxan-4-yl)urea Openeye Name: 3-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]-1-methyl-1-tetrahydropyran-4-yl-urea CAS Name: 3-[6-(2-fluoro-4-nitrophenoxy)-4-pyrimidinyl]-1-methyl-1-(4-oxanyl)urea IUPAC Name: 3-[6-(2-fluoro-4-nitrophenoxy)pyrimidin-4-yl]-1-methyl-1-(oxan-4-yl)urea Traditional Name: 3-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]-1-methyl-1-tetrahydropyran-4-yl-urea Formula: C17H18FN5O5 MolecularWeight: 391.353723

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)C(=O)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

CN(C1CCOCC1)C(=O)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C17H18FN5O5/c1-22(11-4-6-27-7-5-11)17(24)21-15-9-16(20-10-19-15)28-14-3-2-12(23(25)26)8-13(14)18/h2-3,8-11H,4-7H2,1H3,(H,19,20,21,24)