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Details

Stereochemistry ACHIRAL
Molecular Formula C12H10N3S.Cl
Molecular Weight 263.746
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIONINE

SMILES

[Cl-].NC1=CC2=[S+]C3=C(C=CC(N)=C3)N=C2C=C1

InChI

InChIKey=ANRHNWWPFJCPAZ-UHFFFAOYSA-M
InChI=1S/C12H10N3S.ClH/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;/h1-6H,13-14H2;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C12H9N3S
Molecular Weight 227.285
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:09:51 GMT 2023
Edited
by admin
on Fri Dec 15 18:09:51 GMT 2023
Record UNII
VTT2SAT5H0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THIONINE
MI  
Systematic Name English
KATALYSIN
Common Name English
PHENOTHIAZIN-5-IUM, 3,7-DIAMINO-, CHLORIDE (1:1)
Systematic Name English
3,7-DIAMINOPHENAZATHIONIUM CHLORIDE
Common Name English
NSC-56342
Code English
NSC-9591
Code English
C.I. 52000
Common Name English
THIONINE [MI]
Common Name English
CI-52000
Common Name English
LAUTH'S VIOLET
Common Name English
Code System Code Type Description
MERCK INDEX
m10769
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY Merck Index
FDA UNII
VTT2SAT5H0
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
NSC
56342
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
NSC
9591
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-470-3
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
CHEBI
52295
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
CAS
581-64-6
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
WIKIPEDIA
THIONINE
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID90883445
Created by admin on Fri Dec 15 18:09:51 GMT 2023 , Edited by admin on Fri Dec 15 18:09:51 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE