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Substance Name: SHR-1258 dimaleate
RN: 1397922-61-0
UNII: 85KUE857XM
InChIKey: KLHFGQSCVQPTIN-XUZAKNADSA-N

Molecular Formula

  • C32-H31-Cl-N6-O3.2C4-H4-O4

Molecular Weight

  • 815.2321
 
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Names and Synonyms

Name of Substance

  • SHR-1258 dimaleate

Synonyms

  • 2-Propenamide, N-(4-((3-chloro-4-(2-pyridinylmethoxy)phenyl)amino)-3-cyano-7-ethoxy-6-quinolinyl)-3-((2R)-1-methyl-2-pyrrolidinyl)-, (2E)-, (2Z)-2-butenedioate (1:2)
  • SHR-1258 dimaleate
  • UNII-85KUE857XM

Registry Numbers

CAS Registry Number

  • 1397922-61-0

FDA UNII

  • 85KUE857XM

System Generated Number

  • 1397922610

Structure Descriptors

InChI

1S/C32H31ClN6O3.2C4H4O4/c1-3-41-30-17-27-25(16-28(30)38-31(40)12-10-24-8-6-14-39(24)2)32(21(18-34)19-36-27)37-22-9-11-29(26(33)15-22)42-20-23-7-4-5-13-35-23;2*5-3(6)1-2-4(7)8/h4-5,7,9-13,15-17,19,24H,3,6,8,14,20H2,1-2H3,(H,36,37)(H,38,40);2*1-2H,(H,5,6)(H,7,8)/b12-10+;2*2-1-/t24-;;/m1../s1

InChIKey

KLHFGQSCVQPTIN-XUZAKNADSA-N

Smiles

CCOc1c(cc2c(c(cnc2c1)C#N)Nc3cc(c(cc3)OCc4ncccc4)Cl)NC(=O)/C=C/[C@@H]5N(CCC5)C.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O