CHEBI:31519 - dothiepin hydrochloride

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ChEBI Name dothiepin hydrochloride
ChEBI ID CHEBI:31519
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formulae C19H22ClNS
C19H22NS.Cl
Net Charge 0
Average Mass 331.90342
Monoisotopic Mass 331.11615
InChI InChI=1S/C19H21NS.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H
InChIKey XUPZAARQDNSRJB-UHFFFAOYSA-N
SMILES [Cl-].[H]C(CC[N+]([H])(C)C)=C1c2ccccc2CSc2ccccc12
Roles Classification
Application(s): antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dothiepin hydrochloride (CHEBI:31519) has part dothiepin (CHEBI:36798)
dothiepin hydrochloride (CHEBI:31519) has role antidepressant (CHEBI:35469)
dothiepin hydrochloride (CHEBI:31519) is a hydrochloride (CHEBI:36807)
Incoming cis-dothiepin hydrochloride (CHEBI:36804) is a dothiepin hydrochloride (CHEBI:31519)
trans-dothiepin hydrochloride (CHEBI:36805) is a dothiepin hydrochloride (CHEBI:31519)
IUPAC Name
3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine hydrochloride
Synonyms Sources
dosulepin chloride ChemIDplus
dosulepin hydrochloride ChemIDplus
dothiepin hydrochloride ChemIDplus
Prothiaden ChemIDplus
Manual Xref Database
D01546 KEGG DRUG
View more database links
Registry Numbers Types Sources
4339832 Beilstein Registry Number Beilstein
897-15-4 CAS Registry Number ChemIDplus
Last Modified
14 June 2016