Chem
J-GLOBAL ID:201107014209416181   Nikkaji number:J2.931.004A

GW-1100

GW-1100
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: C27H25FN4O4S
Molecular formula furigana: C27-H25-F-N4-O4-S
Molecular weight: 520.580
InChI: InChI=1S/C27H25FN4O4S/c1-3-35-25(34)20-7-11-23(12-8-20)32-16-21(13-19-14-29-26(30-15-19)36-4-2)24(33)31-27(32)37-17-18-5-9-22(28)10-6-18/h5-12,14-16H,3-4,13,17H2,1-2H3
InChI key: PTPNCCWOTBBVJR-UHFFFAOYSA-N
SMILES: CCOC(=O)c1ccc(cc1)n1cc(Cc2cnc(OCC)nc2)c(=O)nc1SCc1ccc(F)cc1
Systematic name  (3):
  • 4-[5-[(2-エトキシピリミジン-5-イル)メチル]-2-(4-フルオロベンジルチオ)-1,4-ジヒドロ-4-オキソピリミジン-1-イル]安息香酸エチル
  • エチル 4-{5-[(2-エトキシピリミジン-5-イル)メチル]-2-{[(4-フルオロフェニル)メチル]スルファニル}-4-オキソ-1,4-ジヒドロピリミジン-1-イル}ベンゾアート
  • ethyl 4-{5-[(2-ethoxypyrimidin-5-yl)methyl]-2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxo-1,4-dihydropyrimidin-1-yl}benzoate
Other name (2):
  • 4-[5-[(2-Ethoxypyrimidine-5-yl)methyl]-2-(4-fluorobenzylthio)-1,4-dihydro-4-oxopyrimidine-1-yl]benzoic acid ethyl ester
  • GW-1100
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