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Details

Stereochemistry ACHIRAL
Molecular Formula C7H9N3OS
Molecular Weight 183.231
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATH-18534

SMILES

CC1=NNC(SCC=C)=NC1=O

InChI

InChIKey=BWAQMHZNDIIZKW-UHFFFAOYSA-N
InChI=1S/C7H9N3OS/c1-3-4-12-7-8-6(11)5(2)9-10-7/h3H,1,4H2,2H3,(H,8,10,11)

HIDE SMILES / InChI

Molecular Formula C7H9N3OS
Molecular Weight 183.231
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 Sat Dec 16 11:00:05 GMT 2023
Edited
by admin
on Sat Dec 16 11:00:05 GMT 2023
Record UNII
V78F7TLP21
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ATH-18534
Common Name English
AS-TRIAZIN-5-OL, 3-(ALLYLTHIO)-6-METHYL-
Systematic Name English
1,2,4-TRIAZIN-5(2H)-ONE, 6-METHYL-3-(2-PROPEN-1-YLTHIO)-
Systematic Name English
1,2,4-TRIAZIN-5(2H)-ONE, 6-METHYL-3-(2-PROPENYLTHIO)-
Systematic Name English
3-ALLYLTHIO-1,2,4-TRIAZIN-5-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
135408854
Created by admin on Sat Dec 16 11:00:05 GMT 2023 , Edited by admin on Sat Dec 16 11:00:05 GMT 2023
PRIMARY
FDA UNII
V78F7TLP21
Created by admin on Sat Dec 16 11:00:05 GMT 2023 , Edited by admin on Sat Dec 16 11:00:05 GMT 2023
PRIMARY
CAS
87450-64-4
Created by admin on Sat Dec 16 11:00:05 GMT 2023 , Edited by admin on Sat Dec 16 11:00:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID40236346
Created by admin on Sat Dec 16 11:00:05 GMT 2023 , Edited by admin on Sat Dec 16 11:00:05 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY