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Details

Stereochemistry ACHIRAL
Molecular Formula C24H42N2O2S2
Molecular Weight 454.732
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of ALBITIAZOLIUM

SMILES

CC1=C(CCO)SC=[N+]1CCCCCCCCCCCC[N+]2=CSC(CCO)=C2C

InChI

InChIKey=UZPXHZIQHWKNPF-UHFFFAOYSA-N
InChI=1S/C24H42N2O2S2/c1-21-23(13-17-27)29-19-25(21)15-11-9-7-5-3-4-6-8-10-12-16-26-20-30-24(14-18-28)22(26)2/h19-20,27-28H,3-18H2,1-2H3/q+2

HIDE SMILES / InChI

Molecular Formula C24H40N2O2S2
Molecular Weight 452.717
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 17:15:32 UTC 2023
Edited
by admin
on Fri Dec 15 17:15:32 UTC 2023
Record UNII
HKM715W3UT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALBITIAZOLIUM
Common Name English
ALBITIAZOLIUM CATION
Common Name English
SAR97276
Code English
ALBITIAZOLIUM ION
Common Name English
SAR-97276
Code English
3,3'-(DODECAN-1,12-DIYL)BIS(5-(2-HYDROXYETHYL)-4-METHYL-1,3-THIAZOL-3-IUM)
Systematic Name English
Code System Code Type Description
PUBCHEM
11377023
Created by admin on Fri Dec 15 17:15:32 UTC 2023 , Edited by admin on Fri Dec 15 17:15:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID10226315
Created by admin on Fri Dec 15 17:15:32 UTC 2023 , Edited by admin on Fri Dec 15 17:15:32 UTC 2023
PRIMARY
SMS_ID
300000042526
Created by admin on Fri Dec 15 17:15:32 UTC 2023 , Edited by admin on Fri Dec 15 17:15:32 UTC 2023
PRIMARY
FDA UNII
HKM715W3UT
Created by admin on Fri Dec 15 17:15:32 UTC 2023 , Edited by admin on Fri Dec 15 17:15:32 UTC 2023
PRIMARY
CAS
753439-46-2
Created by admin on Fri Dec 15 17:15:32 UTC 2023 , Edited by admin on Fri Dec 15 17:15:32 UTC 2023
PRIMARY
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