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Substance Name: Perbufylline [INN]
RN: 110390-84-6
UNII: M69H5TDQ1K
InChIKey: RUELBIYEEYFIQA-UHFFFAOYSA-N

Molecular Formula

  • C23-H28-F-N5-O3

Molecular Weight

  • 441.5042
 
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Names and Synonyms

Name of Substance

  • Perbufylline [INN]

Synonyms

  • 7-(4-(4-(p-Fluorobenzoyl)piperidino)butyl)theophylline
  • Perbufylline
  • UNII-M69H5TDQ1K

Systematic Name

  • 7-(4-(4-(p-Fluorobenzoyl)piperidino)butyl)theophylline.

Registry Numbers

CAS Registry Number

  • 110390-84-6

FDA UNII

  • M69H5TDQ1K

System Generated Number

  • 0110390846

Structure Descriptors

InChI

1S/C23H28FN5O3/c1-26-21-19(22(31)27(2)23(26)32)29(15-25-21)12-4-3-11-28-13-9-17(10-14-28)20(30)16-5-7-18(24)8-6-16/h5-8,15,17H,3-4,9-14H2,1-2H3

InChIKey

RUELBIYEEYFIQA-UHFFFAOYSA-N

Smiles

n1(cnc2n(C)c(=O)n(C)c(=O)c12)CCCCN1CCC(CC1)C(c1ccc(cc1)F)=O