Thiothixene

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Properties Simple | Detailed

Formula C23H29N3O2S2
IUPAC Name (9z)-n,n-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]thioxanthene-2-sulfonamide
Molecular Mass 443.625 g·mol−1
Heat of Formation -69.7 ± 16.7 kJ·mol−1
Dipole Moment 6.33 ± 1.08 D
Volume 527.36 Å 3
Surface Area 406.81 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
Synonyms
  • (9z)-n,n-dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-2-thioxanthenesulfonamide
  • (9z)-n,n-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]thioxanthene-2-sulfonamide
  • (e)-thiothixene
  • 9h-thioxanthene-2-sulfonamide, n, {n-dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-,} (z)-
  • cis-n,n-dimethyl-9-(3-(4-methyl-1-piperazinyl)propylidene)thioxanthene-2-sulfonamide
  • cis-thiothixene
  • d00374
  • p-4657a
  • pdsp1_000038
  • pdsp1_000625
  • pdsp1_000626
  • pdsp2_000038
  • pdsp2_000622
  • thiothixene (usp)
  • thiothixene (z)
  • thioxanthene-2-sulfonamide, n,n-dimethyl-9-(3-(4-methyl-1-piperazinyl)propylidene)-, (e)-
  • thioxanthene-2-sulfonamide, n,n-dimethyl-9-(3-(4-methyl-1-piperazinyl)propylidene)-, (z)-
  • tiotixene (jan)
  • trans-n,n-dimethyl-9-(3-(4-methyl-piperazinyl)propylidene)thioxanthene-2-sulfonamide
  • trans-thiothixene
  • {2-(dimethylsulfamoyl)-[9-(4-methyl-1-piperazinyl)propylidene]thiox} anthene
CAS Number(s)
  • 3313-26-6
  • 3313-27-7
InChIKey GFBKORZTTCHDGY-UWVJOHFNSA-N
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