Chem
J-GLOBAL ID：200907067081160756   Nikkaji number：J1.206.267B

1-[[3-[4-Cyano-4-(2-fluorophenyl)piperidino]propyl]carbamoyl]-2-oxo-4-(methoxymethyl)-6-(3,4-difluorophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester

1-[[3-[4-シアノ-4-(2-フルオロフェニル)ピペリジノ]プロピル]カルバモイル]-2-オキソ-4-(メトキシメチル)-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
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： C30H32F3N5O5
Molecular formula furigana： C30-H32-F3-N5-O5
Molecular weight： 599.611
InChI： InChI=1S/C30H32F3N5O5/c1-42-17-24-25(27(39)43-2)26(19-8-9-22(32)23(33)16-19)38(29(41)36-24)28(40)35-12-5-13-37-14-10-30(18-34,11-15-37)20-6-3-4-7-21(20)31/h3-4,6-9,16,26H,5,10-15,17H2,1-2H3,(H,35,40)(H,36,41)
InChI key： GDBMQKGUAQWBLZ-UHFFFAOYSA-N
SMILES： COCC1=C(C(N(C(=O)NCCCN2CCC(CC2)(C#N)c2ccccc2F)C(=O)N1)c1ccc(F)c(F)c1)C(=O)OC
Systematic name  (3)：
  • 1-[[3-[4-シアノ-4-(2-フルオロフェニル)ピペリジノ]プロピル]カルバモイル]-2-オキソ-4-(メトキシメチル)-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
  • メチル 3-({3-[4-シアノ-4-(2-フルオロフェニル)ピペリジン-1-イル]プロピル}カルバモイル)-4-(3,4-ジフルオロフェニル)-6-(メトキシメチル)-2-オキソ-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 3-({3-[4-cyano-4-(2-fluorophenyl)piperidin-1-yl]propyl}carbamoyl)-4-(3,4-difluorophenyl)-6-(methoxymethyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Other name (1)：
  • 1-[[3-[4-Cyano-4-(2-fluorophenyl)piperidino]propyl]carbamoyl]-2-oxo-4-(methoxymethyl)-6-(3,4-difluorophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester
Thsaurus map：
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