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(Q83108551)
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English
2,3-Piperazinedione, 1-(p-chlorophenyl)-4-(p-(2-pyrimidinylamino)benzyl)-
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
421.13055256000007
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₀ClN₅O₂
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canonical SMILES
C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)NC3=NC=CC=N3)CC4=CC=C(C=C4)Cl
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Identifiers
InChI
InChI=1S/C22H20ClN5O2/c23-18-6-2-16(3-7-18)14-27-12-13-28(21(30)20(27)29)15-17-4-8-19(9-5-17)26-22-24-10-1-11-25-22/h1-11H,12-15H2,(H,24,25,26)
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InChIKey
WEJODZKDXQJYQK-UHFFFAOYSA-N
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CAS Registry Number
77917-23-8
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PubChem CID
3060255
1 reference
matched by identifier from
InChIKey
InChIKey
WEJODZKDXQJYQK-UHFFFAOYSA-N
UniChem compound ID
46967289
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50228555
1 reference
matched by identifier from
InChIKey
InChIKey
WEJODZKDXQJYQK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00151046
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