Neladenoson dalanate

Catalog No. :
ACSSZN549
CAS No. :
1239309-58-0
Molecular Formula :
C35H34ClN7O4S2
Molecular Weight :
716.29

IUPAC Name:2-(4-(2-(((2-(4-chlorophenyl)thiazol-4-yl)methyl)thio)-3,5-dicyano-6-(pyrrolidin-1-yl)pyridin-4-yl)phenoxy)ethyl L-alanyl-L-alaninate

Neladenoson dalanate structure diagram
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Product Information

Product NameNeladenoson dalanate
IUPAC Name2-(4-(2-(((2-(4-chlorophenyl)thiazol-4-yl)methyl)thio)-3,5-dicyano-6-(pyrrolidin-1-yl)pyridin-4-yl)phenoxy)ethyl L-alanyl-L-alaninate
Molecular FormulaC35H34ClN7O4S2
Molecular Weight716.29
SMILESC[C@H](NC([C@@H](N)C)=O)C(OCCOC1=CC=C(C2=C(C#N)C(SCC3=CSC(C4=CC=C(Cl)C=C4)=N3)=NC(N5CCCC5)=C2C#N)C=C1)=O
InChI KeyWESNEIGKOAXSGX-VXKWHMMOSA-N
SynonymNeladenoson dalanate;BAY 10-67197;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;BAY-1067197|||BAY-1067197|||Neladenoson bialanate;Neladenoson bialanate;Neladenoson bialanate hydrochloride
CAS No.1239309-58-0

Synthetic Route by SureRoute

1. ACSSZN549 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACSSZN549 route product structure diagram
    ACSSZN5491239309-58-0
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2. ACSSZN549 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACGNAC403 route compound structure diagram
    ACGNAC4031948-31-8 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACSSZN549 route product structure diagram
    ACSSZN5491239309-58-0
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