Chem
J-GLOBAL ID：200907014012884584   Nikkaji number：J973.627A

1-(4-Fluorophenyl)-2-thioxo-4-phenyl-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid ethyl ester

1-(4-フルオロフェニル)-2-チオキソ-4-フェニル-6-メチル-1,2,3,4-テトラヒドロピリミジン-5-カルボン酸エチル
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： C20H19FN2O2S
Molecular formula furigana： C20-H19-F-N2-O2-S
Molecular weight： 370.440
InChI： InChI=1S/C20H19FN2O2S/c1-3-25-19(24)17-13(2)23(16-11-9-15(21)10-12-16)20(26)22-18(17)14-7-5-4-6-8-14/h4-12,18H,3H2,1-2H3,(H,22,26)
InChI key： AEROXIFMUASKTI-UHFFFAOYSA-N
SMILES： CCOC(=O)C1=C(C)N(C(=S)NC1c1ccccc1)c1ccc(F)cc1
Systematic name  (3)：
  • 1-(4-フルオロフェニル)-2-チオキソ-4-フェニル-6-メチル-1,2,3,4-テトラヒドロピリミジン-5-カルボン酸エチル
  • エチル 1-(4-フルオロフェニル)-6-メチル-4-フェニル-2-スルファニリデン-1,2,3,4-テトラヒドロピリミジン-5-カルボキシラート
  • ethyl 1-(4-fluorophenyl)-6-methyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Other name (1)：
  • 1-(4-Fluorophenyl)-2-thioxo-4-phenyl-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid ethyl ester
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