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(Q82227895)
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NSC696
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
183.05786628799999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₆H₉N₅S
0 references
canonical SMILES
NN=C(S)NN/C=C1\C=CC=N1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
C1=C/C(=C\NNC(=S)NN)/N=C1
0 references
Identifiers
InChI
InChI=1S/C6H9N5S/c7-10-6(12)11-9-4-5-2-1-3-8-5/h1-4,9H,7H2,(H2,10,11,12)/b5-4+
0 references
InChIKey
LZDSWGFBUFIOCW-SNAWJCMRSA-N
0 references
CAS Registry Number
5351-62-2
0 references
DSSTox substance ID
DTXSID00417750
0 references
DSSTOX compound identifier
DTXCID80368599
0 references
NSC number
696
0 references
82634
0 references
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