EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:39665 - N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide

ChEBI IDCHEBI:39665
ChEBI NameN-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide
Stars
ASCII NameN-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide
Last Modified16 May 2008
DownloadsMolfile
FormulaC20H26N6O2S
Net Charge0
Average Mass414.535
Monoisotopic Mass414.18380
SMILES[H]c1c([H])c(-c2c(N([H])[H])nc(N([H])[H])nc2C([H])([H])C([H])([H])[H])c([H])c2c1SC(C([H])([H])[H])(C([H])([H])[H])C(=O)N2C([H])([H])C([H])([H])N([H])C(=O)C([H])([H])[H]
InChIInChI=1S/C20H26N6O2S/c1-5-13-16(17(21)25-19(22)24-13)12-6-7-15-14(10-12)26(9-8-23-11(2)27)18(28)20(3,4)29-15/h6-7,10H,5,8-9H2,1-4H3,(H,23,27)(H4,21,22,24,25)
InChIKeyRMEVNJZCKDVVND-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide (CHEBI:39665) has functional parent acetamide (CHEBI:27856)
N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide (CHEBI:39665) is a aminopyrimidine (CHEBI:38338)
N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamide (CHEBI:39665) is a benzothiazine (CHEBI:46899)
Synonyms  Source
N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL]ETHYL}ACETAMIDEPDBeChem
N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]ethyl}acetamidePDBeChem
Manual XrefsDatabases
1IGPDBeChem