Chem
J-GLOBAL ID：201207027711587773   Nikkaji number：J3.010.144H

N-[α-(Tetrahydrofuran-2-ylmethylcarbamoyl)-4-fluorobenzyl]-N-(4-methoxyphenyl)-1H-benzotriazole-1-acetamide

N-[α-(テトラヒドロフラン-2-イルメチルカルバモイル)-4-フルオロベンジル]-N-(4-メトキシフェニル)-1H-ベンゾトリアゾール-1-アセトアミド
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： C28H28FN5O4
Molecular formula furigana： C28-H28-F-N5-O4
Molecular weight： 517.561
InChI： InChI=1S/C28H28FN5O4/c1-37-22-14-12-21(13-15-22)34(26(35)18-33-25-7-3-2-6-24(25)31-32-33)27(19-8-10-20(29)11-9-19)28(36)30-17-23-5-4-16-38-23/h2-3,6-15,23,27H,4-5,16-18H2,1H3,(H,30,36)
InChI key： HIWKGPKZDUQDKF-UHFFFAOYSA-N
SMILES： COc1ccc(cc1)N(C(C(=O)NCC1CCCO1)c1ccc(F)cc1)C(=O)Cn1nnc2ccccc12
Systematic name  (3)：
  • N-[α-(テトラヒドロフラン-2-イルメチルカルバモイル)-4-フルオロベンジル]-N-(4-メトキシフェニル)-1H-ベンゾトリアゾール-1-アセトアミド
  • 2-[2-(1H-1,2,3-ベンゾトリアゾール-1-イル)-N-(4-メトキシフェニル)アセトアミド]-2-(4-フルオロフェニル)-N-[(オキソラン-2-イル)メチル]アセトアミド
  • 2-[2-(1H-1,2,3-benzotriazol-1-yl)-N-(4-methoxyphenyl)acetamido]-2-(4-fluorophenyl)-N-[(oxolan-2-yl)methyl]acetamide
Other name (1)：
  • N-[α-(Tetrahydrofuran-2-ylmethylcarbamoyl)-4-fluorobenzyl]-N-(4-methoxyphenyl)-1H-benzotriazole-1-acetamide
Thsaurus map：
Thesaurus Map

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