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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H17N4O4S2.Cl
Molecular Weight 380.871
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIAMINE SULFATE HYDROCHLORIDE

SMILES

[Cl-].CC1=C(CCOS(O)(=O)=O)SC=[N+]1CC2=CN=C(C)N=C2N

InChI

InChIKey=MAAYLULZVDPJMX-UHFFFAOYSA-N
InChI=1S/C12H16N4O4S2.ClH/c1-8-11(3-4-20-22(17,18)19)21-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7H,3-4,6H2,1-2H3,(H2-,13,14,15,17,18,19);1H

HIDE SMILES / InChI

Approval Year

Name Type Language
THIAMINE SULFATE HYDROCHLORIDE
Common Name English
THIAMINE SULFURIC ACID ESTER
Common Name English
THIAMINE, HYDROGEN SULFATE (ESTER)
Common Name English
THIAMINE, SULFATE
Common Name English
THIAZOLIUM, 3-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-4-METHYL-5-(2-(SULFOOXY)ETHYL)-, CHLORIDE
Systematic Name English
THIAZOLIUM, 3-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-4-METHYL-5-(2-(SULFOOXY)ETHYL)-, CHLORIDE (1:1)
Systematic Name English
2-(3-((4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL)-4-METHYL-1,3-THIAZOL-3-IUM-5-YL)ETHYL SULFATE
Systematic Name English
Code System Code Type Description
PUBCHEM
129318351
Created by admin on Sat Dec 16 14:16:18 GMT 2023 , Edited by admin on Sat Dec 16 14:16:18 GMT 2023
PRIMARY
CAS
15743-04-1
Created by admin on Sat Dec 16 14:16:18 GMT 2023 , Edited by admin on Sat Dec 16 14:16:18 GMT 2023
PRIMARY
FDA UNII
94Y40T3HOG
Created by admin on Sat Dec 16 14:16:18 GMT 2023 , Edited by admin on Sat Dec 16 14:16:18 GMT 2023
PRIMARY