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(Q82096900)
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CHEMBL43163
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
342.4844
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₈N₄S₂
0 references
canonical SMILES
CN1CCN(CC1)C2=NC(=CC(=N2)C3=CC=CS3)C4=CC=CS4
0 references
Identifiers
InChI
InChI=1S/C17H18N4S2/c1-20-6-8-21(9-7-20)17-18-13(15-4-2-10-22-15)12-14(19-17)16-5-3-11-23-16/h2-5,10-12H,6-9H2,1H3
0 references
InChIKey
SMHGSXDLJAVPBU-UHFFFAOYSA-N
0 references
CAS Registry Number
124959-46-2
0 references
PubChem CID
452522
1 reference
matched by identifier from
InChIKey
InChIKey
SMHGSXDLJAVPBU-UHFFFAOYSA-N
UniChem compound ID
371001
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20332355
1 reference
matched by identifier from
InChIKey
InChIKey
SMHGSXDLJAVPBU-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10283448
0 references
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