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Details

Stereochemistry ACHIRAL
Molecular Formula C25H17F3NO6S.K
Molecular Weight 555.564
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FANDOSENTAN POTASSIUM

SMILES

[K+].CCC1=C2OCOC2=CC(=C1)C3=C(N(C4=CC=CC=C4C(F)(F)F)S(=O)(=O)C5=CC=CC=C35)C([O-])=O

InChI

InChIKey=MZWCHWWQSPPZRH-UHFFFAOYSA-M
InChI=1S/C25H18F3NO6S.K/c1-2-14-11-15(12-19-23(14)35-13-34-19)21-16-7-3-6-10-20(16)36(32,33)29(22(21)24(30)31)18-9-5-4-8-17(18)25(26,27)28;/h3-12H,2,13H2,1H3,(H,30,31);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C25H17F3NO6S
Molecular Weight 516.466
Charge -1
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 16:25:01 UTC 2023
Edited
by admin
on Fri Dec 15 16:25:01 UTC 2023
Record UNII
14U0D2SA4K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FANDOSENTAN POTASSIUM
USAN  
USAN  
Official Name English
PD-0180988-0016
Code English
PD-180988
Code English
Potassium 4-(7-ethyl-1,3-benzodioxol-5-yl)-2-[2-(trifluoromethyl)phenyl]-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide
Systematic Name English
PD 180988-0016
Code English
PD 180988
Code English
2H-1,2-BENZOTHIAZINE-3-CARBOXYLIC ACID, 4-(7-ETHYL-1,3-BENZODIOXOL-5-YL)-2-(2-(TRIFLUOROMETHYL)PHENYL)-, 1,1-DIOXIDE, POTASSIUM SALT
Common Name English
CI-1034
Code English
FANDOSENTAN POTASSIUM [USAN]
Common Name English
PD-180988-0016
Code English
FANDOSENTAN POTASSIUM SALT
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID5047249
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
MESH
C419982
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
CAS
221246-12-4
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
SMS_ID
300000044444
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
FDA UNII
14U0D2SA4K
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
NCI_THESAURUS
C72774
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
PUBCHEM
23674746
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110610
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
USAN
NN-13
Created by admin on Fri Dec 15 16:25:01 UTC 2023 , Edited by admin on Fri Dec 15 16:25:01 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY