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(Q82711086)
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English
Methyl [(2-ethyl-1H-imidazole-5-carbothioyl)sulfanyl]acetate
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
244.034019624
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₂N₂O₂S₂
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canonical SMILES
CCC1=NC=C(N1)C(=S)SCC(=O)OC
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Identifiers
InChI
InChI=1S/C9H12N2O2S2/c1-3-7-10-4-6(11-7)9(14)15-5-8(12)13-2/h4H,3,5H2,1-2H3,(H,10,11)
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InChIKey
QGMUPFXAFHKMBY-UHFFFAOYSA-N
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CAS Registry Number
92601-53-1
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PubChem CID
71329200
1 reference
matched by identifier from
InChIKey
InChIKey
QGMUPFXAFHKMBY-UHFFFAOYSA-N
UniChem compound ID
67585008
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90758048
1 reference
matched by identifier from
InChIKey
InChIKey
QGMUPFXAFHKMBY-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60708792
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