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> Main
CHEBI:59119 - thiopropazate
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ChEBI Name
thiopropazate
ChEBI ID
CHEBI:59119
Definition
A phenothiazine derivative in which 10
H
-phenothiazine has a chloro subsitituent at the 2-position and a 3-[4-(2-acetoxyethyl)piperazin-1-yl]propyl group at N-10.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
ZINC000022446680
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Formula
C23H28ClN3O2S
Net Charge
0
Average Mass
446.00500
Monoisotopic Mass
445.15908
InChI
InChI=1S/C23H28ClN3O2S/c1-
18(28)
29-
16-
15-
26-
13-
11-
25(12-
14-
26)
9-
4-
10-
27-
20-
5-
2-
3-
6-
22(20)
30-
23-
8-
7-
19(24)
17-
21(23)
27/h2-
3,5-
8,17H,4,9-
16H2,1H3
InChIKey
AIUHRQHVWSUTGJ-UHFFFAOYSA-N
SMILES
CC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
dopaminergic antagonist
A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
Application
(s):
phenothiazine antipsychotic drug
dopaminergic antagonist
A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
thiopropazate (
CHEBI:59119
)
has role
dopaminergic antagonist (
CHEBI:48561
)
thiopropazate (
CHEBI:59119
)
has role
phenothiazine antipsychotic drug (
CHEBI:37930
)
thiopropazate (
CHEBI:59119
)
is a
N
-alkylpiperazine (
CHEBI:46845
)
thiopropazate (
CHEBI:59119
)
is a
acetate ester (
CHEBI:47622
)
thiopropazate (
CHEBI:59119
)
is a
organochlorine compound (
CHEBI:36683
)
thiopropazate (
CHEBI:59119
)
is a
phenothiazines (
CHEBI:38093
)
IUPAC Name
2-{4-[3-(2-chloro-10
H
-phenothiazin-10-yl)propyl]piperazin-1-yl}ethyl acetate
INNs
Sources
thiopropazate
KEGG DRUG
thiopropazatum
ChemIDplus
tiopropazato
ChemIDplus
Synonyms
Sources
1-(2-Acetoxyethyl)-4-(3-(2-chloro-10-phenothiazinyl)propyl)piperazine
ChemIDplus
10-(3-(1-(2-Acetoxyethyl)-4-piperazinyl)propyl)-2-chlorophenothiazine
ChemIDplus
2-(4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazinyl)ethyl acetate
NIST Chemistry WebBook
2-Chloro-10-(3-(1-(2-acetoxyethyl)-4-piperazinyl)propyl)phenothiazine
ChemIDplus
4-(3-(2-Chlorophenothiazin-10-yl)propyl)-1-piperazineethanol acetate
NIST Chemistry WebBook
N-(beta-Acetoxyethyl)-N'-(gamma-(2'-chloro-10'-phenothiazinyl)propyl)piperazine
ChemIDplus
Thiopropazat
ChemIDplus
Manual Xrefs
Databases
2634
DrugCentral
D09216
KEGG DRUG
Thiopropazate
Wikipedia
US2766235
Patent
View more database links
Registry Numbers
Types
Sources
770207
Reaxys Registry Number
Reaxys
84-06-0
CAS Registry Number
ChemIDplus
84-06-0
CAS Registry Number
NIST Chemistry WebBook
Citations
Last Modified
22 February 2017