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Substance Name: o-Pyrimidine derivative abacavir
RN: 1443421-69-9
UNII: 8YR0EYX97M
InChIKey: GETKMSKGQYJOPI-SCZZXKLOSA-N

Molecular Formula

  • C18-H21-Cl-N10-O

Molecular Weight

  • 428.8859
 
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Names and Synonyms

Name of Substance

  • o-Pyrimidine derivative abacavir

Synonyms

  • Abacavir related compound D
  • N6-Cyclopropyl-9-((1R,4S)-4-((2,5-diamino-6-chloropyrimidin-4-yloxy)methyl)cyclopent-2-enyl(-9H-purine-2,6-diamine
  • o-Pyrimidine derivative abacavir
  • UNII-8YR0EYX97M

Registry Numbers

CAS Registry Number

  • 1443421-69-9

FDA UNII

  • 8YR0EYX97M

System Generated Number

  • 1443421699

Structure Descriptors

InChI

1S/C18H21ClN10O/c19-13-11(20)16(28-17(21)25-13)30-6-8-1-4-10(5-8)29-7-23-12-14(24-9-2-3-9)26-18(22)27-15(12)29/h1,4,7-10H,2-3,5-6,20H2,(H2,21,25,28)(H3,22,24,26,27)/t8-,10+/m1/s1

InChIKey

GETKMSKGQYJOPI-SCZZXKLOSA-N

Smiles

c1nc2c(nc(nc2n1[C@@H]3C[C@@H](C=C3)COc4c(c(nc(n4)N)Cl)N)N)NC5CC5