Chem
J-GLOBAL ID:200907026524925795   Nikkaji number:J2.719.910K

(2S,3R)-1,2-Diphenyl-3-(2-pyrimidinylamino)-3-(4-chlorophenyl)propane-1-one

(2S,3R)-1,2-ジフェニル-3-(2-ピリミジニルアミノ)-3-(4-クロロフェニル)プロパン-1-オン
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: C25H20ClN3O
Molecular formula furigana: C25-H20-CL-N3-O
Molecular weight: 413.910
InChI: InChI=1S/C25H20ClN3O/c26-21-14-12-19(13-15-21)23(29-25-27-16-7-17-28-25)22(18-8-3-1-4-9-18)24(30)20-10-5-2-6-11-20/h1-17,22-23H,(H,27,28,29)/t22-,23-/m0/s1
InChI key: LCHVKXRUHKCFQR-GOTSBHOMSA-N
SMILES: Clc1ccc(cc1)[C@H](Nc1ncccn1)[C@@H](C(=O)c1ccccc1)c1ccccc1
Systematic name  (3):
  • (2S,3R)-1,2-ジフェニル-3-(2-ピリミジニルアミノ)-3-(4-クロロフェニル)プロパン-1-オン
  • (2S,3R)-3-(4-クロロフェニル)-1,2-ジフェニル-3-[(ピリミジン-2-イル)アミノ]プロパン-1-オン
  • (2S,3R)-3-(4-chlorophenyl)-1,2-diphenyl-3-[(pyrimidin-2-yl)amino]propan-1-one
Other name (1):
  • (2S,3R)-1,2-Diphenyl-3-(2-pyrimidinylamino)-3-(4-chlorophenyl)propane-1-one
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