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Details

Stereochemistry ACHIRAL
Molecular Formula C19H17N2S.CH3O4S
Molecular Weight 416.514
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of THIAZOLE ORANGE METHYL SULFATE

SMILES

COS([O-])(=O)=O.CN1C2=C(S\C1=C/C3=CC=[N+](C)C4=CC=CC=C34)C=CC=C2

InChI

InChIKey=DKHFKLGBHXWXAW-UHFFFAOYSA-M
InChI=1S/C19H17N2S.CH4O4S/c1-20-12-11-14(15-7-3-4-8-16(15)20)13-19-21(2)17-9-5-6-10-18(17)22-19;1-5-6(2,3)4/h3-13H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula CH3O4S
Molecular Weight 111.097
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H17N2S
Molecular Weight 305.417
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:45:44 GMT 2023
Edited
by admin
on Sat Dec 16 13:45:44 GMT 2023
Record UNII
QWL4US8W9A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THIAZOLE ORANGE METHYL SULFATE
Common Name English
QUINOLINIUM, 1-METHYL-4-((3-METHYL-2(3H)-BENZOTHIAZOLYLIDENE)METHYL)-, METHYL SULFATE (1:1)
Systematic Name English
THIAZOLE ORANGE METHYL SULFATE [MI]
Common Name English
Code System Code Type Description
FDA UNII
QWL4US8W9A
Created by admin on Sat Dec 16 13:45:44 GMT 2023 , Edited by admin on Sat Dec 16 13:45:44 GMT 2023
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MERCK INDEX
m10730
Created by admin on Sat Dec 16 13:45:44 GMT 2023 , Edited by admin on Sat Dec 16 13:45:44 GMT 2023
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CAS
172668-52-9
Created by admin on Sat Dec 16 13:45:44 GMT 2023 , Edited by admin on Sat Dec 16 13:45:44 GMT 2023
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PUBCHEM
155907602
Created by admin on Sat Dec 16 13:45:44 GMT 2023 , Edited by admin on Sat Dec 16 13:45:44 GMT 2023
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