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CHEBI:91686 - 6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide

ChEBI IDCHEBI:91686
ChEBI Name6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC13H18ClN3O4S2
Net Charge0
Average Mass379.891
Monoisotopic Mass379.04273
SMILESNS(=O)(=O)c1cc2c(cc1Cl)NC(CC1CCCC1)NS2(=O)=O
InChIInChI=1S/C13H18ClN3O4S2/c14-9-6-10-12(7-11(9)22(15,18)19)23(20,21)17-13(16-10)5-8-3-1-2-4-8/h6-8,13,16-17H,1-5H2,(H2,15,18,19)
InChIKeyBKYKPTRYDKTTJY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide (CHEBI:91686) is a benzothiadiazine (CHEBI:50265)
Manual XrefsDatabases
LSM-1529LINCS
756DrugCentral
Registry NumbersSources
CAS:742-20-1DrugCentral