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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H48F3N7O6S
Molecular Weight 871.966
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Zomiradomide, (S)-

SMILES

CC(C)(O)C1=CC2=C(SC(=N2)[C@H]3CC[C@H](CN4CC5(CC(CCNC6=CC=CC7=C6C(=O)N([C@H]8CCC(=O)NC8=O)C7=O)C5)C4)CC3)C=C1NC(=O)C9=CC=CC(=N9)C(F)(F)F

InChI

InChIKey=WDRJGMSUTPVXDH-CWAYLNQUSA-N
InChI=1S/C45H48F3N7O6S/c1-43(2,61)28-17-32-34(18-31(28)51-38(57)30-7-4-8-35(50-30)45(46,47)48)62-40(52-32)26-11-9-24(10-12-26)21-54-22-44(23-54)19-25(20-44)15-16-49-29-6-3-5-27-37(29)42(60)55(41(27)59)33-13-14-36(56)53-39(33)58/h3-8,17-18,24-26,33,49,61H,9-16,19-23H2,1-2H3,(H,51,57)(H,53,56,58)/t24-,26-,33-/m0/s1

HIDE SMILES / InChI

Molecular Formula C45H48F3N7O6S
Molecular Weight 871.966
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 13:38:22 GMT 2025
Edited
by admin
on Wed Apr 02 13:38:22 GMT 2025
Record UNII
UAP7LA4M5Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-{2-[trans-4-[(6-{2-[2-(2,6-Dioxo-3S-piperidyl)-1,3-dioxo-4-isoindolinylamino]ethyl}-2-aza-2-spiro[3.3]heptyl)methyl]cyclohexyl]-5-(1-hydroxy-1-methylethyl)-1,3-benzothiazol-6-yl}-6-(trifluoromethyl)-2-pyridinecarboxamide
Preferred Name English
Zomiradomide, (S)-
Common Name English
Code System Code Type Description
CAS
2655659-02-0
Created by admin on Wed Apr 02 13:38:22 GMT 2025 , Edited by admin on Wed Apr 02 13:38:22 GMT 2025
PRIMARY
FDA UNII
UAP7LA4M5Q
Created by admin on Wed Apr 02 13:38:22 GMT 2025 , Edited by admin on Wed Apr 02 13:38:22 GMT 2025
PRIMARY