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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H25N3
Molecular Weight 331.454
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CENTHAQUINE

SMILES

CC1=CC(=CC=C1)N2CCN(CCC3=CC=C4C=CC=CC4=N3)CC2

InChI

InChIKey=UJNWGFBJUHIJKK-UHFFFAOYSA-N
InChI=1S/C22H25N3/c1-18-5-4-7-21(17-18)25-15-13-24(14-16-25)12-11-20-10-9-19-6-2-3-8-22(19)23-20/h2-10,17H,11-16H2,1H3

HIDE SMILES / InChI

Molecular Formula C22H25N3
Molecular Weight 331.454
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:44:35 GMT 2023
Edited
by admin
on Fri Dec 15 18:44:35 GMT 2023
Record UNII
QD4VI0J9T5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CENTHAQUINE
USAN   INN  
Official Name English
centhaquine [INN]
Common Name English
COMPOUND-7173
Code English
QUINOLINE, 2-(2-(4-(3-METHYLPHENYL)-1-PIPERAZINYL)ETHYL)-
Systematic Name English
CENTHAQUINE [USAN]
Common Name English
2-(2-(4-(3-METHYLPHENYL)PIPERAZIN-1-YL)ETHYL)QUINOLINE
Systematic Name English
PMZ-2010
Code English
Centhaquine [WHO-DD]
Common Name English
PMZ2010
Code English
Code System Code Type Description
SMS_ID
300000010795
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
PUBCHEM
162163
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
CAS
57961-90-7
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
INN
11138
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
FDA UNII
QD4VI0J9T5
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID40206680
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
NCI_THESAURUS
C171678
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
USAN
HI-253
Created by admin on Fri Dec 15 18:44:35 GMT 2023 , Edited by admin on Fri Dec 15 18:44:35 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET -> AGONIST
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY