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(Q82229122)
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NSC294611
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
294.043901744
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₃H₁₂Cl₂N₄
0 references
canonical SMILES
Cc1cc(C)nc(N/N=C/c2c(Cl)cccc2Cl)n1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CC1=CC(=NC(=N1)N/N=C/C2=C(C=CC=C2Cl)Cl)C
0 references
Identifiers
InChI
InChI=1S/C13H12Cl2N4/c1-8-6-9(2)18-13(17-8)19-16-7-10-11(14)4-3-5-12(10)15/h3-7H,1-2H3,(H,17,18,19)/b16-7+
0 references
InChIKey
HZNZQSMGLLINQZ-FRKPEAEDSA-N
0 references
CAS Registry Number
63110-84-9
0 references
PubChem CID
5359031
1 reference
matched by identifier from
InChIKey
InChIKey
HZNZQSMGLLINQZ-FRKPEAEDSA-N
UniChem compound ID
16199873
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50418550
1 reference
matched by identifier from
InChIKey
InChIKey
HZNZQSMGLLINQZ-FRKPEAEDSA-N
DSSTOX compound identifier
DTXCID70369398
0 references
NSC number
294611
0 references
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