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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H21F3N2O2
Molecular Weight 378.3881
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TILAPERTIN

SMILES

OC(=O)CN1CCN(CC1)[C@H](C2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChIKey=MDLQJNCGZVDZFV-LJQANCHMSA-N
InChI=1S/C20H21F3N2O2/c21-20(22,23)17-8-4-7-16(13-17)19(15-5-2-1-3-6-15)25-11-9-24(10-12-25)14-18(26)27/h1-8,13,19H,9-12,14H2,(H,26,27)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H21F3N2O2
Molecular Weight 378.3881
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:01:43 UTC 2023
Edited
by admin
on Fri Dec 15 16:01:43 UTC 2023
Record UNII
A2SV488G98
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TILAPERTIN
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
tilapertin [INN]
Common Name English
Tilapertin [WHO-DD]
Common Name English
TILAPERTIN [USAN]
Common Name English
1-PIPERAZINEACETIC ACID, 4-((R)-PHENYL(3-(TRIFLUOROMETHYL)PHENYL)METHYL)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29710
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID801032317
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
WIKIPEDIA
Tilapertin
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
FDA UNII
A2SV488G98
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
SMS_ID
300000036975
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
NCI_THESAURUS
C152625
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
PUBCHEM
25063875
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
INN
9852
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
CAS
1000690-85-6
Created by admin on Fri Dec 15 16:01:43 UTC 2023 , Edited by admin on Fri Dec 15 16:01:43 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY