Clotiapine

CAS Registry Number®

2058-52-8

CAS Name

Clotiapine

Molecular Formula

C18H18ClN3S

Molecular Mass

343.87

Cite this Page

Clotiapine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2058-52-8 (retrieved 2024-11-22) (CAS RN: 2058-52-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    119 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3

InChIKey

InChIKey=KAAZGXDPUNNEFN-UHFFFAOYSA-N

SMILES

ClC=1C=C2C(=NC=3C(SC2=CC1)=CC=CC3)N4CCN(C)CC4

Canonical SMILES

ClC=1C=CC=2SC=3C=CC=CC3N=C(C2C1)N4CCN(C)CC4

Other Names for this Substance

  • Dibenzo[b,f][1,4]thiazepine, 2-chloro-11-(4-methyl-1-piperazinyl)-
  • 2-Chloro-11-(4-methyl-1-piperazinyl)dibenzo[b,f][1,4]thiazepine
  • LW 2159
  • 2-Chloro-11-(4-methylpiperazino)dibenzo[b,f][1,4]thiazepine
  • Clothiapine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration