Orteronel

CAS Registry Number®

566939-85-3

CAS Name

Orteronel

Molecular Formula

C18H17N3O2

Molecular Mass

307.35

Cite this Page

Orteronel.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=426219-23-0 (retrieved 2024-11-21) (CAS RN: 566939-85-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H17N3O2/c1-19-17(22)14-3-2-13-9-15(5-4-12(13)8-14)18(23)6-7-21-11-20-10-16(18)21/h2-5,8-11,23H,6-7H2,1H3,(H,19,22)/t18-/m0/s1

InChIKey

InChIKey=OZPFIJIOIVJZMN-SFHVURJKSA-N

SMILES

O[C@]1(C=2N(CC1)C=NC2)C3=CC4=C(C=C3)C=C(C(NC)=O)C=C4

Canonical SMILES

O=C(NC)C1=CC=C2C=C(C=CC2=C1)C3(O)C4=CN=CN4CC3

Other Names for this Substance

  • 2-Naphthalenecarboxamide, 6-[(7S)-6,7-dihydro-7-hydroxy-5H-pyrrolo[1,2-c]imidazol-7-yl]-N-methyl-
  • 6-[(7S)-6,7-Dihydro-7-hydroxy-5H-pyrrolo[1,2-c]imidazol-7-yl]-N-methyl-2-naphthalenecarboxamide
  • 6-[(7S)-7-Hydroxy-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-7-yl]-N-methyl-2-naphthalenecarboxamide
  • Orteronel
  • TAK 700

Deleted or Replaced CAS Registry Numbers

426219-23-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration