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(Q82977520)
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English
3-(2-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
279.137162164
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₇N₃O
0 references
canonical SMILES
CCC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OC
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Identifiers
InChI
InChI=1S/C17H17N3O/c1-3-12-7-4-5-10-15(12)17-18-16(19-20-17)13-8-6-9-14(11-13)21-2/h4-11H,3H2,1-2H3,(H,18,19,20)
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InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
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CAS Registry Number
69095-83-6
1 reference
stated in
CAS Common Chemistry
retrieved
5 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=69095-83-6
InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
PubChem CID
122000
1 reference
matched by identifier from
InChIKey
InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
UniChem compound ID
93525
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20988816
1 reference
matched by identifier from
InChIKey
InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID701415950
0 references
Human Metabolome Database ID
HMDB0250440
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
UNII
5HK8O3MA34
1 reference
matched by identifier from
InChIKey
InChIKey
GXCZZAKPGMYPDJ-UHFFFAOYSA-N
Probes And Drugs ID
PD160450
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