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Substance Name: 7H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 4-amino-7-((2-hydroxy-1-(hydroxymethyl)ethoxy)methyl)-6-(methylthio)-
RN: 127945-86-2
InChIKey: UVWCAXPTMMSDLT-UHFFFAOYSA-N

Molecular Formula

  • C12-H15-N5-O3-S

Molecular Weight

  • 309.3485
 
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Names and Synonyms

Synonyms

  • 4-Amino-5-cyano-6-(methylthio)-7-((1,3-dihydroxy-2-propoxy)methyl)pyrrolo-(2,3-d)pyrimidine
  • 7-CN-8-MeS-7-deaza-acycloA

Systematic Name

  • 7H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 4-amino-7-((2-hydroxy-1-(hydroxymethyl)ethoxy)methyl)-6-(methylthio)-

Registry Numbers

CAS Registry Number

  • 127945-86-2

System Generated Number

  • 0127945862

Structure Descriptors

InChI

InChI=1S/C12H15N5O3S/c1-21-12-8(2-13)9-10(14)15-5-16-11(9)17(12)6-20-7(3-18)4-19/h5,7,18-19H,3-4,6H2,1H3,(H2,14,15,16)

InChIKey

UVWCAXPTMMSDLT-UHFFFAOYSA-N

Smiles

CSc1c(C#N)c2c(N)ncnc2n1COC(CO)CO