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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H21N7O3
Molecular Weight 431.4472
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Gemlapodect

SMILES

CN1N=CC(C(=O)N2CCOCC2)=C1C(=O)NC3=CC4=NC(=NN4C=C3)C5=CC=CC=C5

InChI

InChIKey=MMCSMWHWVGGCGL-UHFFFAOYSA-N
InChI=1S/C22H21N7O3/c1-27-19(17(14-23-27)22(31)28-9-11-32-12-10-28)21(30)24-16-7-8-29-18(13-16)25-20(26-29)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H,24,30)

HIDE SMILES / InChI

Molecular Formula C22H21N7O3
Molecular Weight 431.4472
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 11:00:17 UTC 2023
Edited
by admin
on Sat Dec 16 11:00:17 UTC 2023
Record UNII
RF3JGD64ZU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Gemlapodect
INN  
Official Name English
gemlapodect [INN]
Common Name English
1-methyl-4-[(morpholin-4-yl)carbonyl]-N-(2- phenyl[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5- carboxamide
Systematic Name English
1H-PYRAZOLE-5-CARBOXAMIDE, 1-METHYL-4-(4-MORPHOLINYLCARBONYL)-N-(2-PHENYL(1,2,4)TRIAZOLO(1,5-A)PYRIDIN-7-YL)-
Systematic Name English
1-methyl-4-[(morpholin-4-yl)carbonyl]-N-(2- phenyl[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5- carboxamide
Systematic Name English
Code System Code Type Description
INN
12566
Created by admin on Sat Dec 16 11:00:17 UTC 2023 , Edited by admin on Sat Dec 16 11:00:17 UTC 2023
PRIMARY
CAS
1380329-87-2
Created by admin on Sat Dec 16 11:00:17 UTC 2023 , Edited by admin on Sat Dec 16 11:00:17 UTC 2023
PRIMARY
PUBCHEM
57377410
Created by admin on Sat Dec 16 11:00:17 UTC 2023 , Edited by admin on Sat Dec 16 11:00:17 UTC 2023
PRIMARY
FDA UNII
RF3JGD64ZU
Created by admin on Sat Dec 16 11:00:17 UTC 2023 , Edited by admin on Sat Dec 16 11:00:17 UTC 2023
PRIMARY
NCI_THESAURUS
C199058
Created by admin on Sat Dec 16 11:00:17 UTC 2023 , Edited by admin on Sat Dec 16 11:00:17 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY