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(Q4974)
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Statements
instance of
type of a chemical entity
0 references
SMILES (without stereochemistry)
CN1C=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-]
0 references
chemical formula
C₉H₇N₇O₂S
1 reference
based on heuristic
inferred from SMILES
mass
277.264
1 reference
based on heuristic
inferred from SMILES
InChI
InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)
1 reference
based on heuristic
inferred from SMILES
InChIKey
LMEKQMALGUDUQG-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from SMILES
PubChem CID
2265
1 reference
based on heuristic
inferred from InChIKey
AOP-Wiki Stressor ID
536
0 references
part of
AOP-Wiki Prototypical Stressors
0 references