1-(3-fluoranyl-4-pyrimidin-2-ylsulfanyl-phenyl)ethanone

Systemtic Name: 1-(3-fluoranyl-4-pyrimidin-2-ylsulfanyl-phenyl)ethanone Openeye Name: 1-(3-fluoro-4-pyrimidin-2-ylsulfanyl-phenyl)ethanone CAS Name: 1-[3-fluoro-4-(2-pyrimidinylthio)phenyl]ethanone IUPAC Name: 1-(3-fluoro-4-pyrimidin-2-ylsulfanylphenyl)ethanone Traditional Name: 1-[3-fluoro-4-(2-pyrimidylthio)phenyl]ethanone Formula: C12H9FN2OS MolecularWeight: 248.276063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SC2=NC=CC=N2)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SC2=NC=CC=N2)F

InChI

InChI=1S/C12H9FN2OS/c1-8(16)9-3-4-11(10(13)7-9)17-12-14-5-2-6-15-12/h2-7H,1H3