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(Q83108843)
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English
1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-6-phenyl-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
260.106196384
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₂N₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
c1ccc(C2=NCc3nn[nH]c3-c3ccccc32)cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C16H12N4/c1-2-6-11(7-3-1)15-12-8-4-5-9-13(12)16-14(10-17-15)18-20-19-16/h1-9H,10H2,(H,18,19,20)
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InChIKey
QNQHIWFLURTUTI-UHFFFAOYSA-N
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CAS Registry Number
78131-59-6
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PubChem CID
3060450
1 reference
matched by identifier from
InChIKey
InChIKey
QNQHIWFLURTUTI-UHFFFAOYSA-N
DSSTox substance ID
DTXSID00228787
1 reference
matched by identifier from
InChIKey
InChIKey
QNQHIWFLURTUTI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50151278
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