1-Piperazineethanol, 4-[2-[(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)oxy]ethyl]-, dimethanesulfonate (salt)

CAS Registry Number®

93779-42-1

CAS Name

1-Piperazineethanol, 4-[2-[(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)oxy]ethyl]-, dimethanesulfonate (salt)

Molecular Formula

C22H27ClN2O2S.2CH4O3S

Cite this Page

1-Piperazineethanol, 4-[2-[(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)oxy]ethyl]-, dimethanesulfonate (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93779-42-1 (retrieved 2024-10-05) (CAS RN: 93779-42-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H27ClN2O2S.CH4O3S/c23-18-5-6-22-19(16-18)20(15-17-3-1-2-4-21(17)28-22)27-14-12-25-9-7-24(8-10-25)11-13-26;1-5(2,3)4/h1-6,16,20,26H,7-15H2;1H3,(H,2,3,4)

InChIKey

InChIKey=KLYCEGRURDKAOB-UHFFFAOYSA-N

SMILES

O(CCN1CCN(CCO)CC1)C2C=3C(SC=4C(C2)=CC=CC4)=CC=C(Cl)C3.S(C)(=O)(=O)O

Canonical SMILES

O=S(=O)(O)C.ClC1=CC=C2SC=3C=CC=CC3CC(OCCN4CCN(CCO)CC4)C2=C1

Other Names for this Substance

  • 1-Piperazineethanol, 4-[2-[(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)oxy]ethyl]-, dimethanesulfonate (salt)
  • Dibenzo[b,f]thiepin, 1-piperazineethanol deriv.

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