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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N4O2S
Molecular Weight 210.213
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,5-TETRAHYDRO-7-METHYL-2-THIOXOPTERIDIN-4,6-DIONE

SMILES

CC1=NC2=C(NC1=O)C(=O)NC(=S)N2

InChI

InChIKey=ASXQSQWURKMTJE-UHFFFAOYSA-N
InChI=1S/C7H6N4O2S/c1-2-5(12)9-3-4(8-2)10-7(14)11-6(3)13/h1H3,(H,9,12)(H2,8,10,11,13,14)

HIDE SMILES / InChI

Molecular Formula C7H6N4O2S
Molecular Weight 210.213
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 Tue Apr 01 17:48:12 GMT 2025
Edited
by admin
on Tue Apr 01 17:48:12 GMT 2025
Record UNII
UMZ4J9738T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,5-TETRAHYDRO-7-METHYL-2-THIOXOPTERIDIN-4,6-DIONE
Systematic Name English
NSC-67306
Preferred Name English
4,6-PTERIDINEDIONE, 1,2,3,5-TETRAHYDRO-7-METHYL-2-THIOXO-
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
230-180-8
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
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FDA UNII
UMZ4J9738T
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
PRIMARY
PUBCHEM
3003790
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID10219964
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
PRIMARY
CAS
6967-57-3
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
PRIMARY
NSC
67306
Created by admin on Tue Apr 01 17:48:12 GMT 2025 , Edited by admin on Tue Apr 01 17:48:12 GMT 2025
PRIMARY