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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:138412 -
N
,
N
'-diphenylthiourea
Main
ChEBI Ontology
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ChEBI Name
N
,
N
'-diphenylthiourea
ChEBI ID
CHEBI:138412
ChEBI ASCII Name
N,N'-diphenylthiourea
Definition
Thiourea in which each nitrogen carries a phenyl substituent.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H12N2S
Net Charge
0
Average Mass
228.314
Monoisotopic Mass
228.07212
InChI
InChI=1S/C13H12N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
InChIKey
FCSHMCFRCYZTRQ-UHFFFAOYSA-N
SMILES
C1=C(NC(NC=2C=CC=CC2)=S)C=CC=C1
Roles Classification
Biological Role
(s):
allergen
A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
N
,
N
'-diphenylthiourea (
CHEBI:138412
)
has role
allergen (
CHEBI:50904
)
N
,
N
'-diphenylthiourea (
CHEBI:138412
)
is a
thioureas (
CHEBI:51276
)
IUPAC Name
N
,
N
'-diphenylthiourea
Synonyms
Sources
1,3-Diphenyl-2-thiourea
ChemIDplus
1,3-Diphenylthiourea
ChemIDplus
diphenylthiourea
ChemIDplus
DPTU
ChEBI
s
-diphenylthiourea
ChemIDplus
Sulfocarbanilide
ChemIDplus
sym
-diphenylthiourea
ChemIDplus
Thiocarbanilide
ChemIDplus
Registry Numbers
Types
Sources
102-08-9
CAS Registry Number
ChemIDplus
102-08-9
CAS Registry Number
NIST Chemistry WebBook
644277
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11011923
PubMed citation
Europe PMC
11722495
PubMed citation
Europe PMC
13914406
PubMed citation
Europe PMC
21073181
PubMed citation
Europe PMC
2138962
PubMed citation
Europe PMC
28295200
PubMed citation
Europe PMC
2957161
PubMed citation
Europe PMC
5871245
PubMed citation
Europe PMC
9145274
PubMed citation
Europe PMC
9197970
PubMed citation
Europe PMC
Last Modified
13 September 2017