Chem
J-GLOBAL ID：200907061103403943   Nikkaji number：J973.626C

1-(4-Fluorophenyl)-2-thioxo-4-(4-methoxyphenyl)-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-(4-メトキシフェニル)-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： C21H21FN2O3S
Molecular formula furigana： C21-H21-F-N2-O3-S
Molecular weight： 400.470
InChI： InChI=1S/C21H21FN2O3S/c1-4-27-20(25)18-13(2)24(16-9-7-15(22)8-10-16)21(28)23-19(18)14-5-11-17(26-3)12-6-14/h5-12,19H,4H2,1-3H3,(H,23,28)
InChI key： MDCVGSFMQMRZFS-UHFFFAOYSA-N
SMILES： CCOC(=O)C1=C(C)N(C(=S)NC1c1ccc(OC)cc1)c1ccc(F)cc1
Systematic name  (3)：
  • 1-(4-フルオロフェニル)-2-チオキソ-4-(4-メトキシフェニル)-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)-4-(4-メトキシフェニル)-6-メチル-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)-4-(4-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Other name (1)：
  • 1-(4-Fluorophenyl)-2-thioxo-4-(4-methoxyphenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid ethyl ester
Thsaurus map：
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