Chem
J-GLOBAL ID：201707010867178765   Nikkaji number：J3.671.643F

2-(4-Methylphenyl)-2H-1-benzothiopyran-4(3H)-one

2-(4-メチルフェニル)-2H-1-ベンゾチオピラン-4(3H)-オン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H14OS
Molecular formula furigana： C16-H14-O-S
Molecular weight： 254.350
InChI： InChI=1S/C16H14OS/c1-11-6-8-12(9-7-11)16-10-14(17)13-4-2-3-5-15(13)18-16/h2-9,16H,10H2,1H3
InChI key： SABAOCZKZPINFN-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)C1CC(=O)c2ccccc2S1
Systematic name  (3)：
  • 2-(4-メチルフェニル)-2H-1-ベンゾチオピラン-4(3H)-オン
  • 2-(4-メチルフェニル)-3,4-ジヒドロ-2H-1-ベンゾチオピラン-4-オン
  • 2-(4-methylphenyl)-3,4-dihydro-2H-1-benzothiopyran-4-one
Other name (1)：
  • 2-(4-Methylphenyl)-2H-1-benzothiopyran-4(3H)-one
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