EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:116835 - N-[3-[butyl(ethyl)amino]propyl]-2-[6-(4-morpholinylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]acetamide

ChEBI IDCHEBI:116835
ChEBI NameN-[3-[butyl(ethyl)amino]propyl]-2-[6-(4-morpholinylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]acetamide
Stars
DownloadsMolfile
FormulaC23H36N4O5S2
Net Charge0
Average Mass512.698
Monoisotopic Mass512.21271
SMILESCCCCN(CC)CCCNC(=O)CN1C(=O)CSc2ccc(S(=O)(=O)N3CCOCC3)cc21
InChIInChI=1S/C23H36N4O5S2/c1-3-5-10-25(4-2)11-6-9-24-22(28)17-27-20-16-19(7-8-21(20)33-18-23(27)29)34(30,31)26-12-14-32-15-13-26/h7-8,16H,3-6,9-15,17-18H2,1-2H3,(H,24,28)
InChIKeyDPIGXTLKHMMHAB-UHFFFAOYSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-[3-[butyl(ethyl)amino]propyl]-2-[6-(4-morpholinylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]acetamide (CHEBI:116835) is a benzothiazine (CHEBI:46899)
Manual XrefsDatabases
LSM-28286LINCS