2-butan-2-ylsulfanyl-1-(5-fluoranyl-2-methoxy-phenyl)ethanone

Systemtic Name: 2-butan-2-ylsulfanyl-1-(5-fluoranyl-2-methoxy-phenyl)ethanone Openeye Name: 1-(5-fluoro-2-methoxy-phenyl)-2-sec-butylsulfanyl-ethanone CAS Name: 2-(butan-2-ylthio)-1-(5-fluoro-2-methoxyphenyl)ethanone IUPAC Name: 2-butan-2-ylsulfanyl-1-(5-fluoro-2-methoxyphenyl)ethanone Traditional Name: 1-(5-fluoro-2-methoxy-phenyl)-2-(sec-butylthio)ethanone Formula: C13H17FO2S MolecularWeight: 256.336283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC(=O)C1=C(C=CC(=C1)F)OC

Isomeric SMILES

CCC(C)SCC(=O)C1=C(C=CC(=C1)F)OC

InChI

InChI=1S/C13H17FO2S/c1-4-9(2)17-8-12(15)11-7-10(14)5-6-13(11)16-3/h5-7,9H,4,8H2,1-3H3