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Details

Stereochemistry ACHIRAL
Molecular Formula C30H30N6O3S
Molecular Weight 554.663
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MILFASARTAN

SMILES

CCCCC1=C(CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4)C(=O)N(CC5=C(C=CS5)C(=O)OC)C(C)=N1

InChI

InChIKey=QVFVAKQHELFATN-UHFFFAOYSA-N
InChI=1S/C30H30N6O3S/c1-4-5-10-26-25(29(37)36(19(2)31-26)18-27-24(15-16-40-27)30(38)39-3)17-20-11-13-21(14-12-20)22-8-6-7-9-23(22)28-32-34-35-33-28/h6-9,11-16H,4-5,10,17-18H2,1-3H3,(H,32,33,34,35)

HIDE SMILES / InChI

Molecular Formula C30H30N6O3S
Molecular Weight 554.663
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:14:15 UTC 2023
Edited
by admin
on Fri Dec 15 16:14:15 UTC 2023
Record UNII
8UAL5421CL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MILFASARTAN
INN  
INN  
Official Name English
milfasartan [INN]
Common Name English
METHYL 2-((4-BUTYL-2-METHYL-6-OXO-5-(P-(O-1H-TETRAZOL-5-YLPHENYL)BENZYL)-1(6H)-PYRIMIDINYL)METHYL)-3-THIOPHENECARBOXYLATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66930
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
Code System Code Type Description
MESH
C527223
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
CAS
148564-47-0
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
SMS_ID
100000080633
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
ChEMBL
CHEMBL429847
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
FDA UNII
8UAL5421CL
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
INN
7557
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID70164007
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
NCI_THESAURUS
C66152
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
EVMPD
SUB08963MIG
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
PUBCHEM
3047757
Created by admin on Fri Dec 15 16:14:15 UTC 2023 , Edited by admin on Fri Dec 15 16:14:15 UTC 2023
PRIMARY
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TARGET -> INHIBITOR
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