2-[(4-fluorophenyl)methyl]-2,4-dimethyl-5-oxidanyl-thiophen-3-one

Systemtic Name: 2-[(4-fluorophenyl)methyl]-2,4-dimethyl-5-oxidanyl-thiophen-3-one Openeye Name: 2-[(4-fluorophenyl)methyl]-5-hydroxy-2,4-dimethyl-thiophen-3-one CAS Name: 2-[(4-fluorophenyl)methyl]-5-hydroxy-2,4-dimethyl-3-thiophenone IUPAC Name: 2-[(4-fluorophenyl)methyl]-5-hydroxy-2,4-dimethylthiophen-3-one Traditional Name: 2-(4-fluorobenzyl)-5-hydroxy-2,4-dimethyl-thiophen-3-one Formula: C13H13FO2S MolecularWeight: 252.304523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(C1=O)(C)CC2=CC=C(C=C2)F)O

Isomeric SMILES

CC1=C(SC(C1=O)(C)CC2=CC=C(C=C2)F)O

InChI

InChI=1S/C13H13FO2S/c1-8-11(15)13(2,17-12(8)16)7-9-3-5-10(14)6-4-9/h3-6,16H,7H2,1-2H3