Chem
J-GLOBAL ID：200907032947832483   Nikkaji number：J1.909.324G

(3S,4S,5R)-2-Phenyl-5-[2-(1-pyrrolidinyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]tetrahydro-1H-pyrazole-3,4-dicarboxylic acid dimethyl ester

(3S,4S,5R)-2-フェニル-5-[2-(1-ピロリジニル)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]テトラヒドロ-1H-ピラゾール-3,4-ジカルボン酸ジメチル
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： C25H27N5O5
Molecular formula furigana： C25-H27-N5-O5
Molecular weight： 477.521
InChI： InChI=1S/C25H27N5O5/c1-34-24(32)18-20(27-30(21(18)25(33)35-2)16-10-4-3-5-11-16)19-22(28-13-8-9-14-28)26-17-12-6-7-15-29(17)23(19)31/h3-7,10-12,15,18,20-21,27H,8-9,13-14H2,1-2H3/t18-,20+,21-/m0/s1
InChI key： QWIVKUQOCJDYTQ-TYPHKJRUSA-N
SMILES： COC(=O)[C@H]1[C@@H](NN([C@@H]1C(=O)OC)c1ccccc1)c1c(nc2ccccn2c1=O)N1CCCC1
Systematic name  (3)：
  • (3S,4S,5R)-2-フェニル-5-[2-(1-ピロリジニル)-4-オキソ-4H-ピリド[1,2-a]ピリミジン-3-イル]テトラヒドロ-1H-ピラゾール-3,4-ジカルボン酸ジメチル
  • 3,4-ジメチル (3S,4S,5R)-5-[4-オキソ-2-(ピロリジン-1-イル)-4H-ピリド[1,2-a]ピリミジン-3-イル]-2-フェニルピラゾリジン-3,4-ジカルボキシラート
  • 3,4-dimethyl (3S,4S,5R)-5-[4-oxo-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-phenylpyrazolidine-3,4-dicarboxylate
Other name (1)：
  • (3S,4S,5R)-2-Phenyl-5-[2-(1-pyrrolidinyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-yl]tetrahydro-1H-pyrazole-3,4-dicarboxylic acid dimethyl ester
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