Chemical Compound

(2S,4R)-1-[(2S)-2-[[(5R)-5-[2-[3-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]pyrimidin-5-yl]bicyclo[2.2.2]octane-2-carbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)-2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide

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(2S,4R)-1-[(2S)-2-[[(5R)-5-[2-[3-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]pyrimidin-5-yl]bicyclo[2.2.2]octane-2-carbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)-2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide 结构式
Primary record

(2S,4R)-1-[(2S)-2-[[(5R)-5-[2-[3-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]pyrimidin-5-yl]bicyclo[2.2.2]octane-2-carbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)-2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
155405399
SMILES
CC1=C(SC=N1)C2=CC(=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)C4CC5CCC4C[C@H]5C6=CN=C(N=C6)N7C8CCC7CN(C8)C9=CC(=NN=C9N)C1=CC=CC=C1O)O)C(F)(F)F
Canonical SMILES
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2CC3CCC2C[C@H]3c2cnc(N3C4CCC3CN(c3cc(-c5ccccc5O)nnc3N)C4)nc2)C(C)(C)C)c(C(F)(F)F)c1

名称与同义词

  • SCHEMBL22794791
  • UFXZSAVVYUDZOL-WZNLXEPJSA-N
  • (2S,4R)-1-[(2S)-2-[[(5R)-5-[2-[3-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]pyrimidin-5-yl]bicyclo[2.2.2]octane-2-carbonyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)-2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide