(4E)-4-[[3-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-4-methoxy-phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[3-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-4-methoxy-phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[3-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-4-methoxy-phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[3-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-4-methoxyphenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[3-(2-chloro-5-fluoropyrimidin-4-yl)oxy-4-methoxyphenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[3-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-4-methoxy-benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H16ClFN4O3 MolecularWeight: 438.838843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OC)OC3=NC(=NC=C3F)Cl)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OC)OC3=NC(=NC=C3F)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClFN4O3/c1-13-16(21(29)28(27-13)15-6-4-3-5-7-15)10-14-8-9-18(30-2)19(11-14)31-20-17(24)12-25-22(23)26-20/h3-12H,1-2H3/b16-10+