TROX-1
(Q7671452)
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chemical compound
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Also known as
English
TROX-1
chemical compound
Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical structure
TROX-1 structure.png
704 × 530; 35 KB
0 references
mass
434.8542
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₁₆ClFN₆O
1 reference
stated in
PubChem
canonical SMILES
CC1(C2=C(C=CC(=C2)C3=CC(=C(C=C3)F)Cl)N(C1=O)C4=NC=NN4)CC5=CN=CN=C5
1 reference
stated in
PubChem
Identifiers
InChI
InChI=1S/C22H16ClFN6O/c1-22(8-13-9-25-11-26-10-13)16-6-14(15-2-4-18(24)17(23)7-15)3-5-19(16)30(20(22)31)21-27-12-28-29-21/h2-7,9-12H,8H2,1H3,(H,27,28,29)
1 reference
stated in
PubChem
InChIKey
OABSWPUPIHULMQ-UHFFFAOYSA-N
1 reference
stated in
PubChem
CAS Registry Number
1141080-15-0
1 reference
InChIKey
OABSWPUPIHULMQ-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1141080-15-0
ChemSpider ID
24750794
1 reference
imported from Wikimedia project
English Wikipedia
PubChem CID
25256198
1 reference
imported from Wikimedia project
English Wikipedia
UniChem compound ID
28057072
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40649497
1 reference
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
DSSTOX compound identifier
DTXCID60600247
0 references
Freebase ID
/m/0fq0gtx
0 references
Microsoft Academic ID
2778902538
0 references
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enwiki
TROX-1
shwiki
TROX-1
srwiki
TROX-1
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