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(Q82994981)
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English
3-(2-Methylphenyl)-2-(methylsulfanyl)pyrimidin-4(3H)-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
232.303
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₂N₂OS
0 references
canonical SMILES
CC1=CC=CC=C1N2C(=O)C=CN=C2SC
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Identifiers
InChI
InChI=1S/C12H12N2OS/c1-9-5-3-4-6-10(9)14-11(15)7-8-13-12(14)16-2/h3-8H,1-2H3
0 references
InChIKey
YGZIRFYZUCMQEH-UHFFFAOYSA-N
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CAS Registry Number
80306-55-4
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PubChem CID
100236
1 reference
matched by identifier from
InChIKey
InChIKey
YGZIRFYZUCMQEH-UHFFFAOYSA-N
UniChem compound ID
59202990
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID301001159
1 reference
matched by identifier from
InChIKey
InChIKey
YGZIRFYZUCMQEH-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID201428112
0 references
NSC number
270014
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