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Substance Name: 1H-Pyrrolo(2,3-d)pyrimidine-5-carboxamide, 2-amino-7-(2,4-dihydroxybutyl)-4,7-dihydro-6-(methylthio)-4-oxo-, (S)-
RN: 127945-66-8
InChIKey: GOMZOYDPIFBHKL-YFKPBYRVSA-N

Molecular Formula

  • C12-H17-N5-O4-S

Molecular Weight

  • 327.3633
 
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Names and Synonyms

Synonyms

  • 2-Amino-5-(aminocarbonyl)-6-(methylthio)-7-((S)-2,4-dihydroxybutyl)pyrrolo-(2,3-d)pyrimidin-4-one
  • 7-NH2CO-8-MeS-9-(2,4-diOHBu)-7-deazaG

Systematic Name

  • 1H-Pyrrolo(2,3-d)pyrimidine-5-carboxamide, 2-amino-7-(2,4-dihydroxybutyl)-4,7-dihydro-6-(methylthio)-4-oxo-, (S)-

Registry Numbers

CAS Registry Number

  • 127945-66-8

System Generated Number

  • 0127945668

Structure Descriptors

InChI

1S/C12H17N5O4S/c1-22-11-6(8(13)20)7-9(15-12(14)16-10(7)21)17(11)4-5(19)2-3-18/h5,18-19H,2-4H2,1H3,(H2,13,20)(H3,14,15,16,21)/t5-/m0/s1

InChIKey

GOMZOYDPIFBHKL-YFKPBYRVSA-N

Smiles

CSc1c(c2c(=O)[nH]c(nc2n1C[C@H](CCO)O)N)C(=O)N