trans-prothiadene hydrochloride

Molecular Formula: C19H22ClNS


InChI: InChI=1/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/b17-11+;/fC19H22NS.Cl/h20H;1h/q+1;-1

InChIKey: InChIKey=XUPZAARQDNSRJB-PUTPZEKNDS
SMILES: [Cl-].[H][N+](C)(C)CC\C=C1/c2ccccc2CSc3ccccc13

CAS number 25627-36-5

Names:
    trans-dothiepin hydrochloride
    trans-prothiadene hydrochloride
    trans-11-(3-dimethylaminopropylidene)-6,11-dihydrodibenzo(b,e)thiepin hydrochloride

Registries:
    PubChem CID 6433931
    Beilstein =3637519
    CAS 25627-36-5 (from NIST)
    ChEBI 36805
    PubChem ID 11620721