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Details

Stereochemistry ACHIRAL
Molecular Formula C19H19Cl2N3O2
Molecular Weight 392.279
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIPITROBAN

SMILES

CC(C)(CC(O)=O)CC1=NC2=C(N=CC(Cl)=C2)N1CC3=CC=C(Cl)C=C3

InChI

InChIKey=NJDYXRUUHUXUDU-UHFFFAOYSA-N
InChI=1S/C19H19Cl2N3O2/c1-19(2,9-17(25)26)8-16-23-15-7-14(21)10-22-18(15)24(16)11-12-3-5-13(20)6-4-12/h3-7,10H,8-9,11H2,1-2H3,(H,25,26)

HIDE SMILES / InChI

Molecular Formula C19H19Cl2N3O2
Molecular Weight 392.279
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Mipitroban (previously known as UP 11677), a thromboxane A2 receptor antagonist that was investigated to treat thrombosis. However, further studies were apparently discontinued.

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:39:14 GMT 2023
Edited
by admin
on Fri Dec 15 16:39:14 GMT 2023
Record UNII
2L6Q871829
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MIPITROBAN
INN  
INN  
Official Name English
6-CHLORO-3-(P-CHLOROBENZYL)-.BETA.,.BETA.-DIMETHYL-3H-IMIDAZO(4,5-B)PYRIDINE-2-BUTYRIC ACID
Common Name English
mipitroban [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C263
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
Code System Code Type Description
FDA UNII
2L6Q871829
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
CAS
136122-46-8
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
INN
7366
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID90159672
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
SMS_ID
100000080662
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
NCI_THESAURUS
C81462
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
ChEMBL
CHEMBL18197
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
EVMPD
SUB08985MIG
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
PUBCHEM
3086644
Created by admin on Fri Dec 15 16:39:14 GMT 2023 , Edited by admin on Fri Dec 15 16:39:14 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY