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

Details

Stereochemistry RACEMIC
Molecular Formula C11H13N3.ClH
Molecular Weight 223.702
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IMAFEN HYDROCHLORIDE

SMILES

Cl.C1CN2C(CN=C2N1)C3=CC=CC=C3

InChI

InChIKey=OGFIMJLYLLFOPU-UHFFFAOYSA-N
InChI=1S/C11H13N3.ClH/c1-2-4-9(5-3-1)10-8-13-11-12-6-7-14(10)11;/h1-5,10H,6-8H2,(H,12,13);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H13N3
Molecular Weight 187.241
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:02:00 GMT 2023
Edited
by admin
on Fri Dec 15 16:02:00 GMT 2023
Record UNII
W0X9P59ZQU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IMAFEN HYDROCHLORIDE
USAN  
USAN  
Official Name English
1H-IMIDAZO(1,2-A)IMIDAZOLE, 2,3,5,6-TETRAHYDRO-3-PHENYL-, HYDROCHLORIDE (1:1)
Systematic Name English
R-25,540
Common Name English
R-25540
Code English
R 25,540
Code English
1H-IMIDAZO(1,2-A)IMIDAZOLE, 2,3,5,6-TETRAHYDRO-5-(OR-3-)-PHENYL-, MONOHYDROCHLORIDE
Common Name English
2,3,5,6-Tetrahydro-5-(or-3-)-phenyl-1H-imidazo[1,2-a]imidazole monohydrochloride
Common Name English
IMAFEN HYDROCHLORIDE [USAN]
Common Name English
IMAFEN HCL
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
Code System Code Type Description
CAS
60891-42-1
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
SUPERSEDED
NCI_THESAURUS
C65889
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID70967999
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
PUBCHEM
163315
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
CAS
59198-19-5
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
NON-SPECIFIC STOICHIOMETRY
ChEMBL
CHEMBL2104276
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
FDA UNII
W0X9P59ZQU
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
CAS
53361-24-3
Created by admin on Fri Dec 15 16:02:00 GMT 2023 , Edited by admin on Fri Dec 15 16:02:00 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
PARENT -> SALT/SOLVATE
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY