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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H26N4O2.2C2H6O4S
Molecular Weight 606.709
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXAMIDINE DIISETHIONATE

SMILES

OCCS(O)(=O)=O.OCCS(O)(=O)=O.NC(=N)C1=CC=C(OCCCCCCOC2=CC=C(C=C2)C(N)=N)C=C1

InChI

InChIKey=NBVZMBLJRHUOJR-UHFFFAOYSA-N
InChI=1S/C20H26N4O2.2C2H6O4S/c21-19(22)15-5-9-17(10-6-15)25-13-3-1-2-4-14-26-18-11-7-16(8-12-18)20(23)24;2*3-1-2-7(4,5)6/h5-12H,1-4,13-14H2,(H3,21,22)(H3,23,24);2*3H,1-2H2,(H,4,5,6)

HIDE SMILES / InChI

Molecular Formula C2H6O4S
Molecular Weight 126.132
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H26N4O2
Molecular Weight 354.446
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 17:49:15 UTC 2023
Edited
by admin
on Fri Dec 15 17:49:15 UTC 2023
Record UNII
023XA5Z50L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXAMIDINE DIISETHIONATE
INCI  
INCI  
Official Name English
Hexamidine isetionate [WHO-DD]
Common Name English
HEXAMIDINE ISETIONATE
MART.   WHO-DD  
Common Name English
4,4'-(HEXAMETHYLENEDIOXY)DIBENZAMIDINE ISETHIONATE
Systematic Name English
HEXAMIDINE DIISETIONATE [EP MONOGRAPH]
Common Name English
HEXAMIDINE DIISETIONATE
EP  
Common Name English
HEXAMIDINE ISETIONATE [MART.]
Common Name English
HEXAMIDINE DIISETHIONATE [INCI]
Common Name English
HEXAMIDINE ISETHIONATE
MI  
Common Name English
HEXOMEDIN
Brand Name English
HEXAMIDINE ISETHIONATE [MI]
Common Name English
RF-2535
Code English
HEXAMIDINE DIISETIONATE [EP IMPURITY]
Common Name English
NSC-115848
Code English
4,4'-(HEXAMETHYLENEDIOXY)DIBENZAMIDINE BIS(2-HYDROXYETHANESULPHONATE)
Systematic Name English
Code System Code Type Description
MERCK INDEX
m6000
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY Merck Index
MESH
C018961
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID60984372
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
DAILYMED
023XA5Z50L
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
ECHA (EC/EINECS)
211-533-5
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
CAS
659-40-5
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
NSC
115848
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
FDA UNII
023XA5Z50L
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
EVMPD
SUB12021MIG
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
PUBCHEM
3080571
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
SMS_ID
100000080187
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
RXCUI
1939371
Created by admin on Fri Dec 15 17:49:15 UTC 2023 , Edited by admin on Fri Dec 15 17:49:15 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY