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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H12F3N3O3S
Molecular Weight 419.377
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZOPOLRESTAT

SMILES

OC(=O)CC1=NN(CC2=NC3=CC(=CC=C3S2)C(F)(F)F)C(=O)C4=CC=CC=C14

InChI

InChIKey=BCSVCWVQNOXFGL-UHFFFAOYSA-N
InChI=1S/C19H12F3N3O3S/c20-19(21,22)10-5-6-15-14(7-10)23-16(29-15)9-25-18(28)12-4-2-1-3-11(12)13(24-25)8-17(26)27/h1-7H,8-9H2,(H,26,27)

HIDE SMILES / InChI

Molecular Formula C19H12F3N3O3S
Molecular Weight 419.377
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 Sat Dec 16 05:18:14 UTC 2023
Edited
by admin
on Sat Dec 16 05:18:14 UTC 2023
Record UNII
1PV3S9WP3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZOPOLRESTAT
INN   MI   USAN  
USAN   INN  
Official Name English
zopolrestat [INN]
Common Name English
3,4-Dihydro-4-oxo-3-[[5-(trifluoromethyl)-2-benzothiazolyl]methyl]-1-phthalazineacetic acid
Systematic Name English
ZOPOLRESTAT [USAN]
Common Name English
ZOPOLRESTAT [MI]
Common Name English
1-PHTHALAZINEACETIC ACID, 3,4-DIHYDRO-4-OXO-3-((5-(TRIFLUOROMETHYL)-2-BENZOTHIAZOLYL)METHYL)-
Common Name English
ALOND
Brand Name English
Zopolrestat [WHO-DD]
Common Name English
CP-73850
Code English
CP-73,850
Code English
Classification Tree Code System Code
NCI_THESAURUS C72880
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
Code System Code Type Description
MESH
C067172
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
INN
6740
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
EVMPD
SUB00189MIG
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
USAN
CC-37
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
ChEMBL
CHEMBL10372
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
NCI_THESAURUS
C82174
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
PUBCHEM
1613
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
MERCK INDEX
m11664
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY Merck Index
SMS_ID
100000078819
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
FDA UNII
1PV3S9WP3D
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
CAS
110703-94-1
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID80149365
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
DRUG BANK
DB08772
Created by admin on Sat Dec 16 05:18:14 UTC 2023 , Edited by admin on Sat Dec 16 05:18:14 UTC 2023
PRIMARY
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