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Substance Name: N-Desmethylapalutamide
RN: 1332391-11-3
UNII: 13RV85F63R
InChIKey: BAANHOAPFBHUDX-UHFFFAOYSA-N

Molecular Formula

  • C20-H13-F4-N5-O2-S

Molecular Weight

  • 463.4137
 
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Names and Synonyms

Name of Substance

  • N-Desmethylapalutamide

Synonyms

  • 4-(7-(6-Cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro(3.4)octan-5-yl)-2-fluorobenzamide
  • Apalutamide metabolite M3
  • ARN-000308
  • ARN000308
  • JNJ-56142060
  • N-Desmethylapalutamide
  • UNII-13RV85F63R

Registry Numbers

CAS Registry Number

  • 1332391-11-3

FDA UNII

  • 13RV85F63R

System Generated Number

  • 1332391113

Structure Descriptors

InChI

InChI=1S/C20H13F4N5O2S/c21-14-7-10(2-3-12(14)16(26)30)29-18(32)28(17(31)19(29)4-1-5-19)11-6-13(20(22,23)24)15(8-25)27-9-11/h2-3,6-7,9H,1,4-5H2,(H2,26,30)

InChIKey

BAANHOAPFBHUDX-UHFFFAOYSA-N

Smiles

NC(=O)c1ccc(cc1F)N2C(=S)N(C(=O)C23CCC3)c4cnc(C#N)c(c4)C(F)(F)F