EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:125364 - 3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine

ChEBI IDCHEBI:125364
ChEBI Name3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine
Stars
Last Modified1 February 2017
DownloadsMolfile
FormulaC17H19ClN2OS
Net Charge0
Average Mass334.872
Monoisotopic Mass334.09066
SMILESCN(C)CCC[N+]1([O-])c2ccccc2Sc2ccc(Cl)cc21
InChIInChI=1S/C17H19ClN2OS/c1-19(2)10-5-11-20(21)14-6-3-4-7-16(14)22-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
InChIKeySUQUPCVMBMERJG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine (CHEBI:125364) is a phenothiazines (CHEBI:38093)
3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine (CHEBI:125364) is a tertiary amine oxide (CHEBI:134363)
Manual XrefsDatabases
LSM-36840LINCS