Thiothixene

CAS Registry Number®

5591-45-7
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CAS Name

Thiothixene

Molecular Formula

C23H29N3O2S2

Molecular Mass

443.63

Cite this Page

Thiothixene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5591-45-7 (retrieved 2024-04-25) (CAS RN: 5591-45-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    123.6-124.6 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H29N3O2S2/c1-24(2)30(27,28)18-10-11-23-21(17-18)19(20-7-4-5-9-22(20)29-23)8-6-12-26-15-13-25(3)14-16-26/h4-5,7-11,17H,6,12-16H2,1-3H3

InChIKey

InChIKey=GFBKORZTTCHDGY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=S(=O)(C1=CC=C2SC=3C=CC=CC3C(=CCCN4CCN(C)CC4)C2=C1)N(C)C

Other Names for this Substance

  • 9H-Thioxanthene-2-sulfonamide, N,N-dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-
  • Thioxanthene-2-sulfonamide, N,N-dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-
  • N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-9H-thioxanthene-2-sulfonamide
  • P 4657B
  • N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]thioxanthene-2-sulfonamide

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