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Details

Stereochemistry ACHIRAL
Molecular Formula C19H22N4O2
Molecular Weight 338.4036
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PUMAPRAZOLE

SMILES

COC(=O)NC1=CC=CC(C)=C1CNC2=CC=CN3C(C)=C(C)N=C23

InChI

InChIKey=NZQTVUWEPPDOKK-UHFFFAOYSA-N
InChI=1S/C19H22N4O2/c1-12-7-5-8-16(22-19(24)25-4)15(12)11-20-17-9-6-10-23-14(3)13(2)21-18(17)23/h5-10,20H,11H2,1-4H3,(H,22,24)

HIDE SMILES / InChI

Molecular Formula C19H22N4O2
Molecular Weight 338.4036
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 15:42:05 UTC 2023
Edited
by admin
on Fri Dec 15 15:42:05 UTC 2023
Record UNII
DK95Z519WL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PUMAPRAZOLE
INN  
INN  
Official Name English
BY-941
Code English
BY941
Code English
pumaprazole [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29723
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
Code System Code Type Description
CAS
158364-59-1
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105279
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
INN
7461
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
NCI_THESAURUS
C73221
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
FDA UNII
DK95Z519WL
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
SMS_ID
100000080844
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
EPA CompTox
DTXSID90166407
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
PUBCHEM
3052764
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
EVMPD
SUB10159MIG
Created by admin on Fri Dec 15 15:42:05 UTC 2023 , Edited by admin on Fri Dec 15 15:42:05 UTC 2023
PRIMARY
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TARGET -> INHIBITOR
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REVERSIBLE
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