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Thiothixene

Properties

Image

Occurences in reactions

MNX_ID

MNXM144863

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₃H₂₉N₃O₂S₂

charge

mass

443.17012

reference

chebi:9571

InChIKey

GFBKORZTTCHDGY-UWVJOHFNSA-N

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-

SMILES

CN1CCN(CC/C=C2/c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9571 chebi:9571	Thiothixene Navane (TN) Tiotixene cis-Thiothixene thiothixene HCl thiothixene hydrochloride
CHEBI:93708 chebi:93708	N,N-dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]-2-thioxanthenesulfonamide
kegg.drug:D00374 keggD:D00374	Thiothixene (USP) Navane (TN) Tiotixene (JAN)
hmdb:HMDB0015560	Thiothixene (9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]-9H-thioxanthene-2-sulfonamide (e)-Thiothixene Navane Pfizer brand OF tiotixene Pfizer brand OF tiotixene dihydrochloride Thiothixine Tiotixene Tiotixene pfizer brand cis-Thiothixene thiothixene
hmdb:HMDB15560 keggD:M_D00374	secondary/obsolete/fantasy identifier