Velusetrag

CAS Registry Number®

866933-46-2

CAS Name

Velusetrag

Molecular Formula

C25H36N4O5S

Molecular Mass

504.64

Cite this Page

Velusetrag.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=866933-46-2 (retrieved 2024-11-22) (CAS RN: 866933-46-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H36N4O5S/c1-16(2)29-23-8-6-5-7-17(23)11-22(25(29)32)24(31)26-18-12-19-9-10-20(13-18)28(19)15-21(30)14-27(3)35(4,33)34/h5-8,11,16,18-21,30H,9-10,12-15H2,1-4H3,(H,26,31)/t18-,19+,20-,21-/m0/s1

InChIKey

InChIKey=HXLOHDZQBKCUCR-WOZUAGRISA-N

SMILES

C([C@H](CN(S(C)(=O)=O)C)O)N1[C@]2(C[C@H](NC(=O)C3=CC=4C(N(C(C)C)C3=O)=CC=CC4)C[C@@]1(CC2)[H])[H]

Canonical SMILES

O=C(NC1CC2N(CC(O)CN(C)S(=O)(=O)C)C(CC2)C1)C3=CC=4C=CC=CC4N(C3=O)C(C)C

Other Names for this Substance

  • 3-Quinolinecarboxamide, 1,2-dihydro-N-[(3-endo)-8-[(2R)-2-hydroxy-3-[methyl(methylsulfonyl)amino]propyl]-8-azabicyclo[3.2.1]oct-3-yl]-1-(1-methylethyl)-2-oxo-
  • 1,2-Dihydro-N-[(3-endo)-8-[(2R)-2-hydroxy-3-[methyl(methylsulfonyl)amino]propyl]-8-azabicyclo[3.2.1]oct-3-yl]-1-(1-methylethyl)-2-oxo-3-quinolinecarboxamide
  • TD 5108
  • 1-Isopropyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid {(endo)-8-[(R)-2-hydroxy-3-(methanesulfonylmethylamino)propyl]- 8-aza-bicyclo[3.2.1]oct-3-yl}amide
  • Velusetrag

CAS INSIGHTSTM
Targeted protein degrader structure, illustration