Chem
J-GLOBAL ID：200907020362876770   Nikkaji number：J1.627.204C

LY-341770

(2S)-2-[4-[2-[(2-アミノ-4-オキソ-4,7-ジヒドロ-3H-ピロロ[2,3-d]ピリミジン)-5-イル]エチル]ベンゾイルアミノ]-4-(2H-テトラゾール-5-イル)酪酸
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： C20H21N9O4
Molecular formula furigana： C20-H21-N9-O4
Molecular weight： 451.447
InChI： InChI=1S/C20H21N9O4/c21-20-24-16-15(18(31)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(30)23-13(19(32)33)7-8-14-26-28-29-27-14/h1-2,4-5,9,13H,3,6-8H2,(H,23,30)(H,32,33)(H,26,27,28,29)(H4,21,22,24,25,31)/t13-/m0/s1
InChI key： MXAFDBCLWLMXSI-ZDUSSCGKSA-N
SMILES： Nc1nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCc3nn[nH]n3)C(=O)O)c2c(=O)[nH]1
Systematic name  (3)：
  • (2S)-2-[4-[2-[(2-アミノ-4-オキソ-4,7-ジヒドロ-3H-ピロロ[2,3-d]ピリミジン)-5-イル]エチル]ベンゾイルアミノ]-4-(2H-テトラゾール-5-イル)酪酸
  • (2S)-2-{[4-(2-{2-アミノ-4-オキソ-3H,4H,7H-ピロロ[2,3-d]ピリミジン-5-イル}エチル)フェニル]ホルムアミド}-4-(2H-1,2,3,4-テトラゾール-5-イル)ブタン酸
  • (2S)-2-{[4-(2-{2-amino-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}ethyl)phenyl]formamido}-4-(2H-1,2,3,4-tetrazol-5-yl)butanoic acid
Other name (2)：
  • (2S)-2-[4-[2-[(2-Amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine)-5-yl]ethyl]benzoylamino]-4-(2H-tetrazole-5-yl)butyric acid
  • LY-341770
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