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CHEBI:36802 - cis-dothiepin

ChEBI IDCHEBI:36802
ChEBI Namecis-dothiepin
Stars
ASCII Namecis-dothiepin
Last Modified18 October 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC19H21NS
Net Charge0
Average Mass295.451
Monoisotopic Mass295.13947
SMILESCN(C)CC/C=C1/c2ccccc2CSc2ccccc21
InChIInChI=1S/C19H21NS/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/b17-11-
InChIKeyPHTUQLWOUWZIMZ-BOPFTXTBSA-N
Roles Classification
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
Application:
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
cis-dothiepin (CHEBI:36802) is a dothiepin (CHEBI:36798)
Incoming Relation(s)
cis-dothiepin hydrochloride (CHEBI:36804) has part cis-dothiepin (CHEBI:36802)
IUPAC Name 
(3Z)-3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine
Registry NumbersSources
Beilstein:1432130Beilstein