Chem
J-GLOBAL ID：200907007232280497   Nikkaji number：J1.206.301F

1-[3-[4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl]propylcarbamoyl]-1,2,3,6-tetrahydro-2-oxo-4-methyl-6-(3,4-difluorophenyl)pyrimidine-5-carboxylic acid methyl ester

1-[3-[4-[3-(トリフルオロメチル)フェニル]-1-ピペラジニル]プロピルカルバモイル]-1,2,3,6-テトラヒドロ-2-オキソ-4-メチル-6-(3,4-ジフルオロフェニル)ピリミジン-5-カルボン酸メチル
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： C28H30F5N5O4
Molecular formula furigana： C28-H30-F5-N5-O4
Molecular weight： 595.571
InChI： InChI=1S/C28H30F5N5O4/c1-17-23(25(39)42-2)24(18-7-8-21(29)22(30)15-18)38(27(41)35-17)26(40)34-9-4-10-36-11-13-37(14-12-36)20-6-3-5-19(16-20)28(31,32)33/h3,5-8,15-16,24H,4,9-14H2,1-2H3,(H,34,40)(H,35,41)
InChI key： KTTHVCJSRNMDJY-UHFFFAOYSA-N
SMILES： COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCN(CC1)c1cccc(c1)C(F)(F)F
Systematic name  (4)：
  • 1-[[3-[4-[3-(トリフルオロメチル)フェニル]-1-ピペラジニル]プロピル]カルバモイル]-2-オキソ-4-メチル-6-(3,4-ジフルオロフェニル)-1,2,3,6-テトラヒドロピリミジン-5-カルボン酸メチル
  • 1-[3-[4-[3-(トリフルオロメチル)フェニル]-1-ピペラジニル]プロピルカルバモイル]-1,2,3,6-テトラヒドロ-2-オキソ-4-メチル-6-(3,4-ジフルオロフェニル)ピリミジン-5-カルボン酸メチル
  • メチル 4-(3,4-ジフルオロフェニル)-6-メチル-2-オキソ-3-[(3-{4-[3-(トリフルオロメチル)フェニル]ピペラジン-1-イル}プロピル)カルバモイル]-1,2,3,4-テトラヒドロピリミジン-5-カルボキシラート
  • methyl 4-(3,4-difluorophenyl)-6-methyl-2-oxo-3-[(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propyl)carbamoyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Other name (2)：
  • 1-[[3-[4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl]propyl]carbamoyl]-2-oxo-4-methyl-6-(3,4-difluorophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester
  • 1-[3-[4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl]propylcarbamoyl]-1,2,3,6-tetrahydro-2-oxo-4-methyl-6-(3,4-difluorophenyl)pyrimidine-5-carboxylic acid methyl ester
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