Chem
J-GLOBAL ID：200907078537559500   Nikkaji number：J2.589.904K

2-(Trifluoromethyl)-3-(2-thienylcarbonyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-5-one

4-(4-メチルフェニル)-3-(チオフェン-2-カルボニル)-2-(トリフルオロメチル)-5,6,7,8-テトラヒドロ-4H-クロメン-5-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： C22H17F3O3S
Molecular formula furigana： C22-H17-F3-O3-S
Molecular weight： 418.430
InChI： InChI=1S/C22H17F3O3S/c1-12-7-9-13(10-8-12)17-18-14(26)4-2-5-15(18)28-21(22(23,24)25)19(17)20(27)16-6-3-11-29-16/h3,6-11,17H,2,4-5H2,1H3
InChI key： TXPFGKFMWIJMFP-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)C1C(=C(OC2=C1C(=O)CCC2)C(F)(F)F)C(=O)c1cccs1
Systematic name  (3)：
  • 2-(トリフルオロメチル)-3-(2-チエニルカルボニル)-4-(4-メチルフェニル)-5,6,7,8-テトラヒドロ-4H-1-ベンゾピラン-5-オン
  • 4-(4-メチルフェニル)-3-(チオフェン-2-カルボニル)-2-(トリフルオロメチル)-5,6,7,8-テトラヒドロ-4H-クロメン-5-オン
  • 4-(4-methylphenyl)-3-(thiophene-2-carbonyl)-2-(trifluoromethyl)-5,6,7,8-tetrahydro-4H-chromen-5-one
Other name (1)：
  • 2-(Trifluoromethyl)-3-(2-thienylcarbonyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-5-one
Thsaurus map：
Thesaurus Map

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