2-methylsulfanyl-1h-pyrimidin-6-one (CED0310010)

Record Information

Version

1.0

Creation Date

2026-09-01 08:04:32 UTC

Update Date

2026-09-01 08:04:32 UTC

SynCED ID

CED0310010

Secondary Accession Numbers

CHEM355711

Identification

Common Name

2-methylsulfanyl-1h-pyrimidin-6-one

Class

Small Molecule

Description

2-methylsulfanyl-1h-pyrimidin-6-one is a chemical compound with the formula C5H6N2OS and an average molecular weight of 142.18 g/mol. It has been identified in or released from one recorded source: Electrical & Electronic Equipment (Television Systems).

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₅H₆N₂OS

Average Molecular Mass

Not Available

Monoisotopic Mass

142.020 g/mol

CAS Registry Number

5751-20-2

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CSC1=NC=CC(=O)N1

InChI Identifier

InChI=1S/C5H6N2OS/c1-9-5-6-3-2-4(8)7-5/h2-3H,1H3,(H,6,7,8)

InChI Key

UYHSQVMHSFXUOA-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
987.0 Log mg/kg [560:1800]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000537	Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.	Electrical & Electronic Equipment	PubChem
CEDs000685	Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.	Building & Construction	PubChem
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	PubChem

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Mitogen-activated protein kinase 14	Q16539	Humans	Predicted (SEA)	Prediction Confidence Score 0.242 Applicability Domain 0.276 Low confidence Statistical Significance 0.38 Supporting Reference Compounds 668 E-value 2958.27
Click to view 3D structure	Glycogen synthase kinase-3 beta	P49841	Humans	Predicted (SEA)	Prediction Confidence Score 0.234 Applicability Domain 0.276 Low confidence Statistical Significance 0.5648 Supporting Reference Compounds 1157 E-value 4396.92
Click to view 3D structure	Glycogen synthase kinase-3 alpha	P49840	Humans	Predicted (SEA)	Prediction Confidence Score 0.233 Applicability Domain 0.276 Low confidence Statistical Significance 0.4928 Supporting Reference Compounds 754 E-value 3836.49
Click to view 3D structure	Dual specificity tyrosine-phosphorylation-regulated kinase 1A	Q13627	Humans	Predicted (SEA)	Prediction Confidence Score 0.232 Applicability Domain 0.25 Low confidence Statistical Significance 0.5196 Supporting Reference Compounds 906 E-value 4044.97
Click to view 3D structure	MAP kinase-activated protein kinase 2	P49137	Humans	Predicted (SEA)	Prediction Confidence Score 0.229 Applicability Domain 0.25 Low confidence Statistical Significance 0.496 Supporting Reference Compounds 679 E-value 3861.4
Click to view 3D structure	Ribosomal protein S6 kinase alpha-3	P51812	Humans	Predicted (SEA)	Prediction Confidence Score 0.228 Applicability Domain 0.25 Low confidence Statistical Significance 0.5269 Supporting Reference Compounds 733 E-value 4101.56
Click to view 3D structure	Dual specificity protein kinase CLK4	Q9HAZ1	Humans	Predicted (SEA)	Prediction Confidence Score 0.226 Applicability Domain 0.233 Low confidence Statistical Significance 0.551 Supporting Reference Compounds 742 E-value 4289.88
Click to view 3D structure	Aurora kinase A	O14965	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.233 Low confidence Statistical Significance 0.6114 Supporting Reference Compounds 996 E-value 4759.47
Click to view 3D structure	Serine/threonine-protein kinase PLK3	Q9H4B4	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.25 Low confidence Statistical Significance 0.4998 Supporting Reference Compounds 561 E-value 3890.59
Click to view 3D structure	Cyclin-dependent kinase 5	Q00535	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.233 Low confidence Statistical Significance 0.5754 Supporting Reference Compounds 779 E-value 4479.37
Click to view 3D structure	Serine/threonine-protein kinase Chk1	O14757	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.233 Low confidence Statistical Significance 0.5992 Supporting Reference Compounds 807 E-value 4664.49
Click to view 3D structure	Cell division cycle 7-related protein kinase	O00311	Humans	Predicted (SEA)	Prediction Confidence Score 0.223 Applicability Domain 0.231 Low confidence Statistical Significance 0.4296 Supporting Reference Compounds 407 E-value 3344.17
Click to view 3D structure	Casein kinase I isoform delta	P48730	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.231 Low confidence Statistical Significance 0.5543 Supporting Reference Compounds 637 E-value 4315.26
Click to view 3D structure	cAMP-dependent protein kinase catalytic subunit alpha	P17612	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.231 Low confidence Statistical Significance 0.5856 Supporting Reference Compounds 735 E-value 4558.85
Click to view 3D structure	Cyclin-dependent kinase 2	P24941	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.231 Low confidence Statistical Significance 0.6497 Supporting Reference Compounds 1029 E-value 5058.25
Click to view 3D structure	Serine/threonine-protein kinase PLK1	P53350	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.231 Low confidence Statistical Significance 0.5776 Supporting Reference Compounds 705 E-value 4496.26
Click to view 3D structure	Serine/threonine-protein kinase pim-1	P11309	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.231 Low confidence Statistical Significance 0.6491 Supporting Reference Compounds 967 E-value 5053.43
Click to view 3D structure	Mitogen-activated protein kinase kinase kinase kinase 2	Q12851	Humans	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.5828 Supporting Reference Compounds 657 E-value 4537.44
Click to view 3D structure	Serine/threonine-protein kinase D3	O94806	Humans	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.5779 Supporting Reference Compounds 628 E-value 4498.75
Click to view 3D structure	Serine/threonine-protein kinase Nek2	P51955	Humans	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.5903 Supporting Reference Compounds 660 E-value 4595.21
Click to view 3D structure	Cyclin-dependent kinase 9	P50750	Humans	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.233 Low confidence Statistical Significance 0.4905 Supporting Reference Compounds 426 E-value 3818.58
Click to view 3D structure	Dual specificity protein kinase CLK2	P49760	Humans	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.231 Low confidence Statistical Significance 0.6098 Supporting Reference Compounds 727 E-value 4747.01
Click to view 3D structure	Dual specificity tyrosine-phosphorylation-regulated kinase 3	O43781	Humans	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.231 Low confidence Statistical Significance 0.4737 Supporting Reference Compounds 412 E-value 3687.41
Click to view 3D structure	RAC-alpha serine/threonine-protein kinase	P31749	Humans	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.231 Low confidence Statistical Significance 0.6366 Supporting Reference Compounds 797 E-value 4955.73
Click to view 3D structure	Mitogen-activated protein kinase 1	P28482	Humans	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.231 Low confidence Statistical Significance 0.6283 Supporting Reference Compounds 763 E-value 4890.96