Thiothixene[硫噻吨]

3313-26-6

CAS Name

(9Z)-N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-9H-thioxanthene-2-sulfonamide

Molecular Formula

C₂₃H₂₉N₃O₂S₂

Molecular Mass

443.63

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/b19-8-

InChIKey

InChIKey=GFBKORZTTCHDGY-UWVJOHFNSA-N

SMILES

C(\CCN1CCN(C)CC1)=C/2\C=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