1-(6-tert-butylpyrimidin-4-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-fluoranyl-phenyl]urea

Systemtic Name: 1-(6-tert-butylpyrimidin-4-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-fluoranyl-phenyl]urea Openeye Name: 1-(6-tert-butylpyrimidin-4-yl)-3-[4-[(2-cyano-4-pyridyl)oxy]-2-fluoro-phenyl]urea CAS Name: 1-(6-tert-butyl-4-pyrimidinyl)-3-[4-[(2-cyano-4-pyridinyl)oxy]-2-fluorophenyl]urea IUPAC Name: 1-(6-tert-butylpyrimidin-4-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-fluorophenyl]urea Traditional Name: 1-(6-tert-butylpyrimidin-4-yl)-3-[4-[(2-cyano-4-pyridyl)oxy]-2-fluoro-phenyl]urea Formula: C21H19FN6O2 MolecularWeight: 406.412963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC=N1)NC(=O)NC2=C(C=C(C=C2)OC3=CC(=NC=C3)C#N)F

Isomeric SMILES

CC(C)(C)C1=CC(=NC=N1)NC(=O)NC2=C(C=C(C=C2)OC3=CC(=NC=C3)C#N)F

InChI

InChI=1S/C21H19FN6O2/c1-21(2,3)18-10-19(26-12-25-18)28-20(29)27-17-5-4-14(9-16(17)22)30-15-6-7-24-13(8-15)11-23/h4-10,12H,1-3H3,(H2,25,26,27,28,29)