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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > halide salt > chloride salt > organic chloride salt > hydrochloride > dothiepin hydrochloride
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > halide salt > chloride salt > organic chloride salt > hydrochloride > dothiepin hydrochloride
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > organic salt > organic halide salt > organic chloride salt > hydrochloride > dothiepin hydrochloride

Preferred term

dothiepin hydrochloride  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

Narrower concepts

charge

  • 0

formula

  • C19H22ClNS
  • C19H22NS.Cl

has_part

has_role

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

mass

  • 331.90342

monoisotopicmass

  • 331.11615

smiles

  • [Cl-].[H]C(CC[N+]([H])(C)C)=C1c2ccccc2CSc2ccccc12

subset

  • 3_STAR

synonym EXACT

  • 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropan-1-amine hydrochloride
  • dothiepin hydrochloride

synonym RELATED

  • dosulepin chloride
  • dosulepin hydrochloride
  • Prothiaden

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31519

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