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English
N~2~-[1-(4-Chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N~1~,N~1~-diethylethane-1,2-diamine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
344.8424
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₁ClN₆
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canonical SMILES
CCN(CC)CCNC1=C2C=NN(C2=NC=N1)C3=CC=C(C=C3)Cl
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Identifiers
InChI
InChI=1S/C17H21ClN6/c1-3-23(4-2)10-9-19-16-15-11-22-24(17(15)21-12-20-16)14-7-5-13(18)6-8-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,20,21)
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InChIKey
VXESXRYAORMYTA-UHFFFAOYSA-N
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CAS Registry Number
5334-60-1
1 reference
InChIKey
VXESXRYAORMYTA-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=5334-60-1
PubChem CID
219771
0 references
UniChem compound ID
24181799
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40967961
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DSSTOX compound identifier
DTXCID001395553
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NSC number
1444
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4914
0 references
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