Chem
J-GLOBAL ID：200907066234123930   Nikkaji number：J2.021.990D

N-Benzyl-2-[3-(2-hydroxyethoxy)phenyl]-Nα-(4-bromophenethyl)-Nα-[(E)-1,4-dioxo-4-(benzylamino)-2-butenyl]glycinamide

(2E)-N-ベンジル-N'-[(ベンジルカルバモイル)[3-(2-ヒドロキシエトキシ)フェニル]メチル]-N'-[2-(4-ブロモフェニル)エチル]ブタ-2-エンジアミド
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： C36H36BrN3O5
Molecular formula furigana： C36-H36-BR-N3-O5
Molecular weight： 670.604
InChI： InChI=1S/C36H36BrN3O5/c37-31-16-14-27(15-17-31)20-21-40(34(43)19-18-33(42)38-25-28-8-3-1-4-9-28)35(30-12-7-13-32(24-30)45-23-22-41)36(44)39-26-29-10-5-2-6-11-29/h1-19,24,35,41H,20-23,25-26H2,(H,38,42)(H,39,44)/b19-18+
InChI key： YPXDQLJIIWGAFP-VHEBQXMUSA-N
SMILES： OCCOc1cccc(c1)C(N(CCc1ccc(Br)cc1)C(=O)/C=C/C(=O)NCc1ccccc1)C(=O)NCc1ccccc1
Systematic name  (3)：
  • N-ベンジル-2-[3-(2-ヒドロキシエトキシ)フェニル]-Nα-(4-ブロモフェネチル)-Nα-[(E)-1,4-ジオキソ-4-(ベンジルアミノ)-2-ブテニル]グリシンアミド
  • (2E)-N-ベンジル-N'-[(ベンジルカルバモイル)[3-(2-ヒドロキシエトキシ)フェニル]メチル]-N'-[2-(4-ブロモフェニル)エチル]ブタ-2-エンジアミド
  • (2E)-N-benzyl-N'-[(benzylcarbamoyl)[3-(2-hydroxyethoxy)phenyl]methyl]-N'-[2-(4-bromophenyl)ethyl]but-2-enediamide
Other name (1)：
  • N-Benzyl-2-[3-(2-hydroxyethoxy)phenyl]-Nα-(4-bromophenethyl)-Nα-[(E)-1,4-dioxo-4-(benzylamino)-2-butenyl]glycinamide
Thsaurus map：
Thesaurus Map

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