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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 2,3-DIHYDRO-6-METHYL-2-THIOXO-4,7(1H,8H)-PTERIDINEDIONE

SMILES

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

InChI

InChIKey=JZIIMNMIDVPMED-UHFFFAOYSA-N
InChI=1S/C7H6N4O2S/c1-2-5(12)9-4-3(8-2)6(13)11-7(14)10-4/h1H3,(H3,9,10,11,12,13,14)

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 19:26:26 GMT 2025
Edited
by admin
on Tue Apr 01 19:26:26 GMT 2025
Record UNII
R7RW14NC4T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-67305
Preferred Name English
2,3-DIHYDRO-6-METHYL-2-THIOXO-4,7(1H,8H)-PTERIDINEDIONE
Systematic Name English
4,7(1H,8H)-PTERIDINEDIONE, 2,3-DIHYDRO-6-METHYL-2-THIOXO-
Systematic Name English
2,3-DIHYDRO-6-METHYL-2-THIOXO-(1H,8H)-PTERIDINE-4,7-DIONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
302-099-9
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
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PUBCHEM
3034084
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
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NSC
67305
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
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CAS
94088-97-8
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
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FDA UNII
R7RW14NC4T
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID30240497
Created by admin on Tue Apr 01 19:26:26 GMT 2025 , Edited by admin on Tue Apr 01 19:26:26 GMT 2025
PRIMARY