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(Q82649206)
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English
(4E)-4-[3-Methyl-3-(2-phenylethyl)triazan-1-ylidene]-4H-imidazole-5-carboxamide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
272.138559132
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₃H₁₆N₆O
0 references
canonical SMILES
CN(CCc1ccccc1)N/N=C1/N=CN=C1C(N)=O
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CN(CCC1=CC=CC=C1)N/N=C/2\C(=NC=N2)C(=O)N
0 references
Identifiers
InChI
InChI=1S/C13H16N6O/c1-19(8-7-10-5-3-2-4-6-10)18-17-13-11(12(14)20)15-9-16-13/h2-6,9,18H,7-8H2,1H3,(H2,14,20)/b17-13+
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InChIKey
CZFMSOQFVYAOCP-GHRIWEEISA-N
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CAS Registry Number
56010-85-6
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DSSTox substance ID
DTXSID00713047
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DSSTOX compound identifier
DTXCID80663793
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NSC number
146371
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208825
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