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Substance Name: Ubrogepant [USAN:INN]
RN: 1374248-77-7
UNII: AD0O8X2QJR
InChIKey: DDOOFTLHJSMHLN-ZQHRPCGSSA-N

Note

  • A calcitonin gene-related peptide receptor antagonist (CGRP-RA), for the acute treatment of migraine.

Molecular Formula

  • C29-H26-F3-N5-O3

Molecular Weight

  • 549.5504
 

Classification Code

  • Treatment of Migraine
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Names and Synonyms

Name of Substance

  • Ubrogepant [USAN:INN]

Synonyms

  • Spiro(6H-cyclopenta(b)pyridine-6,3'-(3H)pyrrolo(2,3-b)pyridine)-3-carboxamide, 1',2',5,7-tetrahydro-N-((3S,5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3-piperidinyl)-2'-oxo-, (3'S)-
  • Ubrogepant
  • UNII-AD0O8X2QJR

Systematic Name

  • (3'S)-N-((3S,5S,6R)-6-Methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-3-yl)-2'-oxo-1',2',5,7-tetrahydrospiro(cyclopenta(b)pyridine-6,3'-pyrrolo(2,3-b)pyridine)-3-carboxamide

Registry Numbers

CAS Registry Number

  • 1374248-77-7

FDA UNII

  • AD0O8X2QJR

System Generated Number

  • 1374248777

Structure Descriptors

InChI

1S/C29H26F3N5O3/c1-16-20(17-6-3-2-4-7-17)11-22(26(39)37(16)15-29(30,31)32)35-25(38)19-10-18-12-28(13-23(18)34-14-19)21-8-5-9-33-24(21)36-27(28)40/h2-10,14,16,20,22H,11-13,15H2,1H3,(H,35,38)(H,33,36,40)/t16-,20-,22+,28+/m1/s1

InChIKey

DDOOFTLHJSMHLN-ZQHRPCGSSA-N

Smiles

C[C@@H]1[C@@H](C[C@H](NC(=O)c2cnc3C[C@]4(Cc3c2)C(=O)Nc5ncccc45)C(=O)N1CC(F)(F)F)c6ccccc6