Chem
J-GLOBAL ID:200907050745510407   Nikkaji number:J848.582H

2,3-Diacetoxysuccinic acid 1-[1-(tert-butylaminomethyl)-2-(4-morpholino-1,2,5-thiadiazol-3-yloxy)ethyl] ester

2,3-ジアセトキシこはく酸1-[1-(tert-ブチルアミノメチル)-2-(4-モルホリノ-1,2,5-チアジアゾール-3-イルオキシ)エチル]
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C21H32N4O10S
Molecular formula furigana: C21-H32-N4-O10-S
Molecular weight: 532.570
InChI: InChI=1S/C21H32N4O10S/c1-12(26)33-15(19(28)29)16(34-13(2)27)20(30)35-14(10-22-21(3,4)5)11-32-18-17(23-36-24-18)25-6-8-31-9-7-25/h14-16,22H,6-11H2,1-5H3,(H,28,29)
InChI key: LSHPCGMHTPBLSC-UHFFFAOYSA-N
SMILES: CC(=O)OC(C(OC(=O)C)C(=O)OC(CNC(C)(C)C)COc1nsnc1N1CCOCC1)C(=O)O
Systematic name  (3):
  • 2,3-ジアセトキシこはく酸1-[1-(tert-ブチルアミノメチル)-2-(4-モルホリノ-1,2,5-チアジアゾール-3-イルオキシ)エチル]
  • 2,3-ビス(アセチルオキシ)-4-{[1-(tert-ブチルアミノ)-3-{[4-(モルホリン-4-イル)-1,2,5-チアジアゾール-3-イル]オキシ}プロパン-2-イル]オキシ}-4-オキソブタン酸
  • 2,3-bis(acetyloxy)-4-{[1-(tert-butylamino)-3-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}propan-2-yl]oxy}-4-oxobutanoic acid
Other name (1):
  • 2,3-Diacetoxysuccinic acid 1-[1-(tert-butylaminomethyl)-2-(4-morpholino-1,2,5-thiadiazol-3-yloxy)ethyl] ester
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