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Substance Name: AEE 788
RN: 497839-62-0
UNII: F9JLR95I3I
InChIKey: OONFNUWBHFSNBT-HXUWFJFHSA-N

Molecular Formula

  • C27-H32-N6

Molecular Weight

  • 440.5918
 
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Names and Synonyms

Name of Substance

  • AEE 788

Synonym

  • UNII-F9JLR95I3I

Systematic Name

  • 1H-Pyrrolo(2,3-d)pyrimidin-4-amine, 6-(4-((4-ethyl-1-piperazinyl)methyl)phenyl)-N-((1R)-1-phenylethyl)-

Registry Numbers

CAS Registry Number

  • 497839-62-0

FDA UNII

  • F9JLR95I3I

System Generated Number

  • 0497839620

Structure Descriptors

InChI

1S/C27H32N6/c1-3-32-13-15-33(16-14-32)18-21-9-11-23(12-10-21)25-17-24-26(28-19-29-27(24)31-25)30-20(2)22-7-5-4-6-8-22/h4-12,17,19-20H,3,13-16,18H2,1-2H3,(H2,28,29,30,31)/t20-/m1/s1

InChIKey

OONFNUWBHFSNBT-HXUWFJFHSA-N

Smiles

CCN1CCN(Cc2ccc(cc2)c3cc4c(N[C@H](C)c5ccccc5)ncnc4[nH]3)CC1