1,3-Dimethyl-8-((pyridin-3-ylmethyl)thio)-2-thioxo-2,3-dihydro-1H-purin-6(9H)-one

Catalog No. :
ACRFCO568
CAS No. :
6466-15-5
Molecular Formula :
C13H13N5OS2
Molecular Weight :
319.42

IUPAC Name:1,3-dimethyl-8-((pyridin-3-ylmethyl)thio)-2-thioxo-1,2,3,7-tetrahydro-6H-purin-6-one

1,3-Dimethyl-8-((pyridin-3-ylmethyl)thio)-2-thioxo-2,3-dihydro-1H-purin-6(9H)-one structure diagram
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Product Information

Product Name1,3-Dimethyl-8-((pyridin-3-ylmethyl)thio)-2-thioxo-2,3-dihydro-1H-purin-6(9H)-one
IUPAC Name1,3-dimethyl-8-((pyridin-3-ylmethyl)thio)-2-thioxo-1,2,3,7-tetrahydro-6H-purin-6-one
Molecular FormulaC13H13N5OS2
Molecular Weight319.42
SMILESO=C1N(C)C(N(C)C2=C1N=C(SCC3=CC=CN=C3)N2)=S
InChI KeyOCFFPNDSXCDKMN-UHFFFAOYSA-N
Synonym3,7-Dihydro-1,3-dimethyl-8-[(pyridin-3-yl)methylthio]-2-thioxo-1H-purin-6(2H)-one;8-[(3-Pyridylmethyl)thio]-2-thiotheophylline;8-[(3-Pyridylmethyl)thio]-3,7-dihydro-1,3-dimethyl-2-thioxo-1H-purin-6-one;6H-Purin-6-one, 1,2,3,9-tetrahydro-1,3-dimethyl-8-[(3-pyridinylmethyl)thio]-2-thioxo-
CAS No.6466-15-5

Synthetic Route by SureRoute

1. ACRFCO568 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  5. ACRFCO568 route product structure diagram
    ACRFCO5686466-15-5
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2. ACRFCO568 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. ACRFCO568 route product structure diagram
    ACRFCO5686466-15-5
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