2-((2-(Azepan-1-yl)-2-oxoethyl)thio)-6-(trifluoromethyl)pyrimidin-4(3H)-one

Catalog No. :
ACIIRV694
CAS No. :
899990-70-6
Molecular Formula :
C13H16F3N3O2S
Molecular Weight :
335.35

IUPAC Name:2-((2-(azepan-1-yl)-2-oxoethyl)thio)-6-(trifluoromethyl)pyrimidin-4(3H)-one

2-((2-(Azepan-1-yl)-2-oxoethyl)thio)-6-(trifluoromethyl)pyrimidin-4(3H)-one structure diagram
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Product Information

Product Name2-((2-(Azepan-1-yl)-2-oxoethyl)thio)-6-(trifluoromethyl)pyrimidin-4(3H)-one
IUPAC Name2-((2-(azepan-1-yl)-2-oxoethyl)thio)-6-(trifluoromethyl)pyrimidin-4(3H)-one
Molecular FormulaC13H16F3N3O2S
Molecular Weight335.35
SMILESO=C1NC(SCC(N2CCCCCC2)=O)=NC(C(F)(F)F)=C1
InChI KeyRIGAOYLBPBETLP-UHFFFAOYSA-N
Synonym4(3H)-Pyrimidinone, 2-[[2-(hexahydro-1H-azepin-1-yl)-2-oxoethyl]thio]-6-(trifluoromethyl)-
CAS No.899990-70-6

Synthetic Route by SureRoute

1. ACIIRV694 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACLYZC578 route compound structure diagram
    ACLYZC578368-54-7 In Stock
  4. Then
  5. ACIIRV694 route product structure diagram
    ACIIRV694899990-70-6
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2. ACIIRV694 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACIIRV694 route product structure diagram
    ACIIRV694899990-70-6
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