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Substance Name: Neladenoson bialanate [INN]
RN: 1239309-58-0
UNII: IV690462VZ
InChIKey: WESNEIGKOAXSGX-VXKWHMMOSA-N

Molecular Formula

  • C35-H34-Cl-N7-O4-S2

Molecular Weight

  • 716.2836
 
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Names and Synonyms

Results Name

  • Neladenoson bialanate [INN]

Name of Substance

  • Neladenoson bialanate [INN]
  • Neladenoson dalanate [INN]

Synonyms

  • 2-(4-(2-(((2-(4-Chlorophenyl)-1,3-thiazol-4-yl)methyl)sulfanyl)-3,5-dicyano-6-(pyrrolidin-1-yl)pyridin-4-yl)phenoxy)ethyl L-alanyl-L-alaninate
  • L-Alanine, L-alanyl-, 2-(4-(2-(((2-(4-chlorophenyl)-4-thiazolyl)methyl)thio)-3,5-dicyano-6-(1-pyrrolidinyl)-4-pyridinyl)phenoxy)ethyl ester
  • Neladenoson bialanate
  • Neladenoson dalanate
  • Neladenoson dalanate [INN]
  • UNII-IV690462VZ

Registry Numbers

CAS Registry Number

  • 1239309-58-0

FDA UNII

  • IV690462VZ

System Generated Number

  • 1239309580

Structure Descriptors

InChI

1S/C35H34ClN7O4S2/c1-21(39)32(44)40-22(2)35(45)47-16-15-46-27-11-7-23(8-12-27)30-28(17-37)31(43-13-3-4-14-43)42-34(29(30)18-38)49-20-26-19-48-33(41-26)24-5-9-25(36)10-6-24/h5-12,19,21-22H,3-4,13-16,20,39H2,1-2H3,(H,40,44)/t21-,22-/m0/s1

InChIKey

WESNEIGKOAXSGX-VXKWHMMOSA-N

Smiles

C[C@@H](C(=O)N[C@@H](C)C(=O)OCCOc1ccc(cc1)c2c(c(nc(c2C#N)SCc3csc(n3)c4ccc(cc4)Cl)N5CCCC5)C#N)N