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Details

Stereochemistry ACHIRAL
Molecular Formula C6H6N2O3S
Molecular Weight 186.188
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,6-TETRAHYDRO-5-METHYL-2-OXO-6-THIOXO-4-PYRIMIDINECARBOXYLIC ACID

SMILES

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

InChI

InChIKey=MDLXLFIWVDNDJR-UHFFFAOYSA-N
InChI=1S/C6H6N2O3S/c1-2-3(5(9)10)7-6(11)8-4(2)12/h1H3,(H,9,10)(H2,7,8,11,12)

HIDE SMILES / InChI

Molecular Formula C6H6N2O3S
Molecular Weight 186.188
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 19:34:27 GMT 2025
Edited
by admin
on Tue Apr 01 19:34:27 GMT 2025
Record UNII
OK5ID26OZ3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-98533
Preferred Name English
1,2,3,6-TETRAHYDRO-5-METHYL-2-OXO-6-THIOXO-4-PYRIMIDINECARBOXYLIC ACID
Systematic Name English
4-PYRIMIDINECARBOXYLIC ACID, 2-HYDROXY-6-MERCAPTO-5-METHYL-
Common Name English
4-PYRIMIDINECARBOXYLIC ACID, 1,2,3,6-TETRAHYDRO-5-METHYL-2-OXO-6-THIOXO-
Systematic Name English
Code System Code Type Description
CAS
74039-19-3
Created by admin on Tue Apr 01 19:34:27 GMT 2025 , Edited by admin on Tue Apr 01 19:34:27 GMT 2025
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PUBCHEM
3034552
Created by admin on Tue Apr 01 19:34:27 GMT 2025 , Edited by admin on Tue Apr 01 19:34:27 GMT 2025
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NSC
98533
Created by admin on Tue Apr 01 19:34:27 GMT 2025 , Edited by admin on Tue Apr 01 19:34:27 GMT 2025
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FDA UNII
OK5ID26OZ3
Created by admin on Tue Apr 01 19:34:27 GMT 2025 , Edited by admin on Tue Apr 01 19:34:27 GMT 2025
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EPA CompTox
DTXSID50224916
Created by admin on Tue Apr 01 19:34:27 GMT 2025 , Edited by admin on Tue Apr 01 19:34:27 GMT 2025
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