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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H14F3NO3S
Molecular Weight 357.347
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOLRESTAT

SMILES

COC1=C(C2=C(C=C1)C(=CC=C2)C(=S)N(C)CC(O)=O)C(F)(F)F

InChI

InChIKey=LUBHDINQXIHVLS-UHFFFAOYSA-N
InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)

HIDE SMILES / InChI

Molecular Formula C16H14F3NO3S
Molecular Weight 357.347
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 18:55:11 UTC 2023
Edited
by admin
on Fri Dec 15 18:55:11 UTC 2023
Record UNII
0T93LG5NMK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TOLRESTAT
INN   MART.   MI   USAN   WHO-DD  
USAN   INN  
Official Name English
Tolrestat [WHO-DD]
Common Name English
tolrestat [INN]
Common Name English
TOLRESTAT [MART.]
Common Name English
TOLRESTAT [MI]
Common Name English
AY-27,773
Code English
TOLRESTAT [USAN]
Common Name English
N-[6-Methoxythio-5-(trifluoromethyl)-1-naphthoyl]sarcosine
Systematic Name English
ALREDASE
Brand Name English
AY-27773
Code English
GLYCINE, N-((6-METHOXY-5-(TRIFLUOROMETHYL)-1-NAPHTHALENYL)THIOXOMETHYL)-N-METHYL-
Systematic Name English
Classification Tree Code System Code
WHO-VATC QA10XA01
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
NCI_THESAURUS C72880
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
WHO-ATC A10XA01
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
Code System Code Type Description
INN
5529
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
CAS
82964-04-3
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
MESH
C040550
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
NCI_THESAURUS
C96310
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
SMS_ID
100000077766
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
RXCUI
38386
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY RxNorm
USAN
U-19
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
IUPHAR
7404
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
DRUG BANK
DB02383
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
CHEBI
48549
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID80904890
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL436
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
DRUG CENTRAL
2704
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
WIKIPEDIA
Tolrestat
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
MERCK INDEX
m10953
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY Merck Index
PUBCHEM
53359
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
FDA UNII
0T93LG5NMK
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
EVMPD
SUB11179MIG
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
https://en.wikipedia.org/wiki/Tolrestat
Related Record Type Details
ACTIVE MOIETY