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(Q82175038)
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English
Methyl 5-bromo-2-(methylsulfanyl)pyrimidine-4-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
261.94116056400003
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₇BrN₂O₂S
0 references
canonical SMILES
COC(=O)C1=NC(=NC=C1Br)SC
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Identifiers
InChI
InChI=1S/C7H7BrN2O2S/c1-12-6(11)5-4(8)3-9-7(10-5)13-2/h3H,1-2H3
0 references
InChIKey
MYZJIEWTRJTWCD-UHFFFAOYSA-N
0 references
CAS Registry Number
50593-91-4
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PubChem CID
2794729
1 reference
matched by identifier from
InChIKey
InChIKey
MYZJIEWTRJTWCD-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL628538
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MYZJIEWTRJTWCD-UHFFFAOYSA-N
UniChem compound ID
4383763
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90383359
1 reference
matched by identifier from
InChIKey
InChIKey
MYZJIEWTRJTWCD-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10334383
0 references
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