AC1NPOYM structure

AC1NPOYM

ethyl 4-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)sulfanyl-3-oxobutanoate

Also Known As: AG-205/11318147|SR-01000508069-1|ethyl 4-{[2-amino-5-cyano-6-(methylsulfanyl)pyrimidin-4-yl]sulfanyl}-3-oxobutanoate|A0278/0012627|ethyl 4-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)sulfanyl-3-oxobutanoate|ethyl 4-{[2-amino-5-cyano-6-(methylthio)pyrimidin-4-yl]thio}-3-oxobutanoate|Ethyl 4-{[5-cyano-2-imino-6-(methylsulfanyl)-1,2-dihydropyrimidin-4-yl]sulfanyl}-3-oxobutanoate

CAS: 5790-19-2
Molecular Formula C12H14N4O3S2
Molecular Weight 326.05072 g/mol
LogP 1.26678
Topological Polar Surface Area 118.96 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 7
Exact Mass 326.05072
Monoisotopic Mass 326.05072
Heavy Atoms 21
Complexity 586.60065

Chemical Identifiers

CAS Number 5790-19-2
SMILES CCOC(=O)CC(=O)CSC1=NC(=NC(=C1C#N)SC)N

Product Overview

AC1NPOYM (CAS 5790-19-2), with molecular formula C12H14N4O3S2 and molecular weight 326.05072 g/mol. IUPAC: ethyl 4-(2-amino-5-cyano-6-methylsulfanylpyrimidin-4-yl)sulfanyl-3-oxobutanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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