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CHEBI:32218 - Thioproperazine mesilate

ChEBI IDCHEBI:32218
ChEBI NameThioproperazine mesilate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC22H30N4O2S2.2CH4O3S
Net Charge0
Average Mass638.856
Monoisotopic Mass638.15725
SMILESCN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1.CS(=O)(=O)O.CS(=O)(=O)O
InChIInChI=1S/C22H30N4O2S2.2CH4O3S/c1-23(2)30(27,28)18-9-10-22-20(17-18)26(19-7-4-5-8-21(19)29-22)12-6-11-25-15-13-24(3)14-16-25;2*1-5(2,3)4/h4-5,7-10,17H,6,11-16H2,1-3H3;2*1H3,(H,2,3,4)
InChIKeyQPMDKXBBAVQDCB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Thioproperazine mesilate (CHEBI:32218) is a phenothiazines (CHEBI:38093)
Synonym  Source
Thioproperazine mesilateKEGG COMPOUND
Manual XrefsDatabases
D01447KEGG DRUG
Registry NumbersSources
CAS:2347-80-0KEGG COMPOUND