U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C41H45F3N8O5S
Molecular Weight 818.907
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Gridegalutamide

SMILES

CCC1=CC(=CC=C1OCCN2CCN(CC(=O)NC3=CC=CC(N[C@@H]4CCC(=O)NC4=O)=C3)[C@H](C)C2)N5C(=S)N(C(=O)C5(C)C)C6=CC=C(C#N)C(=C6)C(F)(F)F

InChI

InChIKey=YUVGVJYLOFTILT-INJOXJOKSA-N
InChI=1S/C41H45F3N8O5S/c1-5-26-19-31(52-39(58)51(38(56)40(52,3)4)30-10-9-27(22-45)32(21-30)41(42,43)44)11-13-34(26)57-18-17-49-15-16-50(25(2)23-49)24-36(54)47-29-8-6-7-28(20-29)46-33-12-14-35(53)48-37(33)55/h6-11,13,19-21,25,33,46H,5,12,14-18,23-24H2,1-4H3,(H,47,54)(H,48,53,55)/t25-,33-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Gridegalutamide
USAN   INN  
Official Name English
BMS-986409
Preferred Name English
CC-94676, (3R)-
Code English
(2R)-4-[2-[4-[3-[4-Cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-ethylphenoxy]ethyl]-N-[3-[[(3R)-2,6-dioxo-3-piperidinyl]amino]phenyl]-2-methyl-1-piperazineacetamide
Systematic Name English
CC-1083611
Code English
1-Piperazineacetamide, 4-[2-[4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-ethylphenoxy]ethyl]-N-[3-[[(3R)-2,6-dioxo-3-piperidinyl]amino]phenyl]-2-methyl-, (2R)-
Systematic Name English
CC94676
Code English
CC1083611
Code English
CEL-010355
Code English
gridegalutamide [INN]
Common Name English
CC1080412
Code English
GRIDEGALUTAMIDE [USAN]
Common Name English
Code System Code Type Description
SMS_ID
300000054910
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
USAN
LM-229
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
PUBCHEM
153513643
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
INN
13220
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
FDA UNII
VA228VR2DI
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
CAS
2446929-86-6
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY
NCI_THESAURUS
C173364
Created by admin on Wed Apr 02 06:30:28 GMT 2025 , Edited by admin on Wed Apr 02 06:30:28 GMT 2025
PRIMARY