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Details

Stereochemistry RACEMIC
Molecular Formula C17H13ClN3O.C2H5O3S
Molecular Weight 419.882
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRAZIUM ESILATE

SMILES

CCS([O-])(=O)=O.OC1(NC=N[N+]2=C1C3=CC=CC=C3C=C2)C4=CC=C(Cl)C=C4

InChI

InChIKey=SHXJBCWOVPAZQL-UHFFFAOYSA-M
InChI=1S/C17H13ClN3O.C2H6O3S/c18-14-7-5-13(6-8-14)17(22)16-15-4-2-1-3-12(15)9-10-21(16)20-11-19-17;1-2-6(3,4)5/h1-11,22H,(H,19,20);2H2,1H3,(H,3,4,5)/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
TRAZIUM ESILATE
INN  
INN  
Official Name English
TRAZIUM ESILATE, (±)-
Common Name English
(±)-TRAZIUM ESILATE
Common Name English
trazium esilate [INN]
Common Name English
4H-(1,2,4)TRIAZINO(6,1-A)ISOQUINOLIN-5-IUM, 1-(4-CHLOROPHENYL)-1-HYDRO-1-HYDROXY-, ETHANESULFONATE (1:1)
Common Name English
(1,2,4)TRIAZINO(6,1-A)ISOQUINOLIN-5-IUM, 1-(4-CHLOROPHENYL)-1,2-DIHYDRO-1-HYDROXY-, ETHANESULFONATE (SALT)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
Code System Code Type Description
SMS_ID
100000077496
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
INN
5783
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
ChEMBL
CHEMBL2111166
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
NCI_THESAURUS
C72873
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
PUBCHEM
72166
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
EVMPD
SUB11223MIG
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
FDA UNII
1PO9LWW5IN
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
CAS
97110-59-3
Created by admin on Fri Dec 15 15:36:24 UTC 2023 , Edited by admin on Fri Dec 15 15:36:24 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of TRAZIUM
SUBSTANCE RECORD
Structure of TRAZIUM ESILATE
NIH
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