Telcagepant

CAS Registry Number®

781649-09-0

CAS Name

Telcagepant

Molecular Formula

C26H27F5N6O3

Molecular Mass

566.52

Cite this Page

Telcagepant.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=781649-09-0 (retrieved 2024-11-22) (CAS RN: 781649-09-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H27F5N6O3/c27-18-4-1-3-17(21(18)28)15-6-7-19(23(38)36(13-15)14-26(29,30)31)33-24(39)35-11-8-16(9-12-35)37-20-5-2-10-32-22(20)34-25(37)40/h1-5,10,15-16,19H,6-9,11-14H2,(H,33,39)(H,32,34,40)/t15-,19-/m1/s1

InChIKey

InChIKey=CGDZXLJGHVKVIE-DNVCBOLYSA-N

SMILES

O=C1N(C=2C(N1)=NC=CC2)C3CCN(C(N[C@H]4C(=O)N(CC(F)(F)F)C[C@@H](CC4)C5=C(F)C(F)=CC=C5)=O)CC3

Canonical SMILES

O=C1NC2=NC=CC=C2N1C3CCN(C(=O)NC4C(=O)N(CC(C=5C=CC=C(F)C5F)CC4)CC(F)(F)F)CC3

Other Names for this Substance

  • 1-Piperidinecarboxamide, N-[(3R,6S)-6-(2,3-difluorophenyl)hexahydro-2-oxo-1-(2,2,2-trifluoroethyl)-1H-azepin-3-yl]-4-(2,3-dihydro-2-oxo-1H-imidazo[4,5-b]pyridin-1-yl)-
  • N-[(3R,6S)-6-(2,3-Difluorophenyl)hexahydro-2-oxo-1-(2,2,2-trifluoroethyl)-1H-azepin-3-yl]-4-(2,3-dihydro-2-oxo-1H-imidazo[4,5-b]pyridin-1-yl)-1-piperidinecarboxamide
  • MK 0974
  • Telcagepant

CAS INSIGHTSTM
Targeted protein degrader structure, illustration