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CAS Number: 66116-81-2
5-acetyl-2-(methylthio)pyrimidin-4(1H)-one

Structure

5-acetyl-2-(methylthio)pyrimidin-4(1H)-one
Name: 5-acetyl-2-(methylthio)pyrimidin-4(1H)-one
Synonyms:
General Information
Product Number: 66116812

CAS Registry Number 66116-81-2
Name:
4(3H)​-​Pyrimidinone, 5-​acetyl-​2-​(methylthio)​-
4(1H)-Pyrimidinone, 5-acetyl-2-(methylthio)- (9CI)

 

Chemical Formula: C7H8N2O2S
Exact Mass: 184.03
Molecular Weight: 184.22
m/z: 184.03 (100.0%), 185.03 (9.2%), 186.03 (5.1%)

 

InChI:InChI=1S/C7H8N2O2S/c1-4(10)5-3-8-7(12-2)9-6(5)11/h3,5H,1-2H3

InChI Key:BYRIBLYRFMDMHN-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1C=NC(=NC1=O)SC

Specification

98%

References

PCT Int. Appl. (2012), WO 2012085815 A1 20120628. 

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