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Substance Name: 1H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 2-amino-7-(2,4-dihydroxybutyl)-4,7-dihydro-4-oxo-, (S)-
RN: 127945-78-2
InChIKey: PTCOREUWJYMEKE-ZETCQYMHSA-N

Molecular Formula

  • C11-H13-N5-O3

Molecular Weight

  • 263.2557
 
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Names and Synonyms

Synonyms

  • 2-Amino-5-cyano-7-((S)-2,4-dihydroxybutyl)pyrrolo(2,3-d)pyrimidin-4-one
  • 7-CN-9-(2,4-diOHBu)-7-deazaG

Systematic Name

  • 1H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 2-amino-7-(2,4-dihydroxybutyl)-4,7-dihydro-4-oxo-, (S)-

Registry Numbers

CAS Registry Number

  • 127945-78-2

System Generated Number

  • 0127945782

Structure Descriptors

InChI

1S/C11H13N5O3/c12-3-6-4-16(5-7(18)1-2-17)9-8(6)10(19)15-11(13)14-9/h4,7,17-18H,1-2,5H2,(H3,13,14,15,19)/t7-/m0/s1

InChIKey

PTCOREUWJYMEKE-ZETCQYMHSA-N

Smiles

c1c(c2c(=O)[nH]c(nc2n1C[C@H](CCO)O)N)C#N