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

Systemtic Name: 3-[6-(2-fluoranyl-4-nitro-phenoxy)pyrimidin-4-yl]-1,1-dimethyl-urea Openeye Name: 3-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]-1,1-dimethyl-urea CAS Name: 3-[6-(2-fluoro-4-nitrophenoxy)-4-pyrimidinyl]-1,1-dimethylurea IUPAC Name: 3-[6-(2-fluoro-4-nitrophenoxy)pyrimidin-4-yl]-1,1-dimethylurea Traditional Name: 3-[6-(2-fluoro-4-nitro-phenoxy)pyrimidin-4-yl]-1,1-dimethyl-urea Formula: C13H12FN5O4 MolecularWeight: 321.263883

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=CC(=NC=N1)OC2=C(C=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CN(C)C(=O)NC1=CC(=NC=N1)OC2=C(C=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C13H12FN5O4/c1-18(2)13(20)17-11-6-12(16-7-15-11)23-10-4-3-8(19(21)22)5-9(10)14/h3-7H,1-2H3,(H,15,16,17,20)