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Substance Name: 7H-Pyrrolo(2,3-d)pyrimidine-5-carboxamide, 4-amino-7-((2-hydroxy-1-(hydroxymethyl)ethoxy)methyl)-6-(methylthio)-
RN: 127945-92-0
InChIKey: JMVZSBHVPKVTLV-UHFFFAOYSA-N

Molecular Formula

  • C12-H17-N5-O4-S

Molecular Weight

  • 327.3633
 
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Names and Synonyms

Synonyms

  • 4-Amino-5-(aminocarbonyl)-6-(methylthio)-7-((1,3-dihydroxy-2-propoxy)methyl)-pyrrolo(2,3-d)pyrimidine
  • 7-NH2CO-8-MeS-7-deaza-acycloA

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 127945-92-0

System Generated Number

  • 0127945920

Structure Descriptors

InChI

1S/C12H17N5O4S/c1-22-12-8(10(14)20)7-9(13)15-4-16-11(7)17(12)5-21-6(2-18)3-19/h4,6,18-19H,2-3,5H2,1H3,(H2,14,20)(H2,13,15,16)

InChIKey

JMVZSBHVPKVTLV-UHFFFAOYSA-N

Smiles

CSc1c(c2c(ncnc2n1COC(CO)CO)N)C(=O)N