(E)-1-(4-fluorophenyl)-3-iodanyl-2-pyrimidin-5-yl-prop-2-en-1-one

Systemtic Name: (E)-1-(4-fluorophenyl)-3-iodanyl-2-pyrimidin-5-yl-prop-2-en-1-one Openeye Name: (E)-1-(4-fluorophenyl)-3-iodo-2-pyrimidin-5-yl-prop-2-en-1-one CAS Name: (E)-1-(4-fluorophenyl)-3-iodo-2-(5-pyrimidinyl)-2-propen-1-one IUPAC Name: (E)-1-(4-fluorophenyl)-3-iodo-2-pyrimidin-5-ylprop-2-en-1-one Traditional Name: (E)-1-(4-fluorophenyl)-3-iodo-2-(5-pyrimidyl)prop-2-en-1-one Formula: C13H8FIN2O MolecularWeight: 354.118293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C(=CI)C2=CN=CN=C2)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C(=C/I)/C2=CN=CN=C2)F

InChI

InChI=1S/C13H8FIN2O/c14-11-3-1-9(2-4-11)13(18)12(5-15)10-6-16-8-17-7-10/h1-8H/b12-5+