1-[5-fluoranyl-3-(2-methylpropylsulfanylmethyl)-2-oxidanyl-phenyl]ethanone

Systemtic Name: 1-[5-fluoranyl-3-(2-methylpropylsulfanylmethyl)-2-oxidanyl-phenyl]ethanone Openeye Name: 1-[5-fluoro-2-hydroxy-3-(isobutylsulfanylmethyl)phenyl]ethanone CAS Name: 1-[5-fluoro-2-hydroxy-3-[(2-methylpropylthio)methyl]phenyl]ethanone IUPAC Name: 1-[5-fluoro-2-hydroxy-3-(2-methylpropylsulfanylmethyl)phenyl]ethanone Traditional Name: 1-[5-fluoro-2-hydroxy-3-[(isobutylthio)methyl]phenyl]ethanone Formula: C13H17FO2S MolecularWeight: 256.336283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCC1=C(C(=CC(=C1)F)C(=O)C)O

Isomeric SMILES

CC(C)CSCC1=C(C(=CC(=C1)F)C(=O)C)O

InChI

InChI=1S/C13H17FO2S/c1-8(2)6-17-7-10-4-11(14)5-12(9(3)15)13(10)16/h4-5,8,16H,6-7H2,1-3H3