1-(5-fluoranyl-2-methoxy-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(5-fluoranyl-2-methoxy-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-(5-fluoro-2-methoxy-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-(5-fluoro-2-methoxyphenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-(5-fluoro-2-methoxyphenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(5-fluoro-2-methoxy-phenyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]ethanone Formula: C20H17FN2O2S MolecularWeight: 368.424583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C20H17FN2O2S/c1-13-10-17(14-6-4-3-5-7-14)23-20(22-13)26-12-18(24)16-11-15(21)8-9-19(16)25-2/h3-11H,12H2,1-2H3