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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H25Cl2FN2O2
Molecular Weight 475.383
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Taragarestrant

SMILES

C[C@@H]1CC2=C(NC3=C2C=CC=C3)[C@H](N1CC(C)(C)F)C4=C(Cl)C=C(\C=C\C(O)=O)C=C4Cl

InChI

InChIKey=PSJRZBBUWGIUPM-BBNFHIFMSA-N
InChI=1S/C25H25Cl2FN2O2/c1-14-10-17-16-6-4-5-7-20(16)29-23(17)24(30(14)13-25(2,3)28)22-18(26)11-15(12-19(22)27)8-9-21(31)32/h4-9,11-12,14,24,29H,10,13H2,1-3H3,(H,31,32)/b9-8+/t14-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H25Cl2FN2O2
Molecular Weight 475.383
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:05:23 GMT 2023
Edited
by admin
on Sat Dec 16 14:05:23 GMT 2023
Record UNII
KD4HIM135V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Taragarestrant
INN  
Official Name English
2-PROPENOIC ACID, 3-(3,5-DICHLORO-4-((1R,3R)-2-(2-FLUORO-2-METHYLPROPYL)-2,3,4,9-TETRAHYDRO-3-METHYL-1H-PYRIDO(3,4-B)INDOL-1-YL)PHENYL)-, (2E)-
Common Name English
taragarestrant [INN]
Common Name English
D 0502 [WHO-DD]
Common Name English
D0502
Code English
(2E)-3-{3,5-dichloro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1Hpyrido[3,4-b]indol-1-yl]phenyl}prop-2-enoic acid
Systematic Name English
D-0502
Code English
Code System Code Type Description
NCI_THESAURUS
C156735
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
CAS
2118899-51-5
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
FDA UNII
KD4HIM135V
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
PUBCHEM
130330722
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
SMS_ID
300000046269
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
INN
12092
Created by admin on Sat Dec 16 14:05:23 GMT 2023 , Edited by admin on Sat Dec 16 14:05:23 GMT 2023
PRIMARY
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