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CHEBI:39984 - N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]ethyl}acetamide

ChEBI IDCHEBI:39984
ChEBI NameN-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-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-benzoxazin-4-yl]ethyl}acetamide
Last Modified17 October 2009
DownloadsMolfile
FormulaC20H26N6O3
Net Charge0
Average Mass398.467
Monoisotopic Mass398.20664
SMILES[H]c1c([H])c(-c2c(N([H])[H])nc(N([H])[H])nc2C([H])([H])C([H])([H])[H])c([H])c2c1OC(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/C20H26N6O3/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)
InChIKeyGBXSOZDYCSBLQX-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-benzoxazin-4-yl]ethyl}acetamide (CHEBI:39984) 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-benzoxazin-4-yl]ethyl}acetamide (CHEBI:39984) is a benzoxazine (CHEBI:46969)
N-{2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2,2-dimethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]ethyl}acetamide (CHEBI:39984) is a monocarboxylic acid amide (CHEBI:29347)
Synonyms  Source
N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOXAZIN-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-benzoxazin-4-yl]ethyl}acetamidePDBeChem
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