Chem
J-GLOBAL ID：200907082595288750
Nikkaji number：J1.284.916H
(αS)-α-[(3S)-3-(1H-Imidazole-4-ylmethyl)-2-oxo-4-acetylpiperazino]-4-hydroxybenzenepropanamide
(αS)-α-[(3S)-3-(1H-イミダゾール-4-イルメチル)-2-オキソ-4-アセチルピペラジノ]-4-ヒドロキシベンゼンプロパンアミド
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
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
Molecular formula： C19H23N5O4
Molecular formula furigana： C19-H23-N5-O4
Molecular weight： 385.424
InChI：
InChI=1S/C19H23N5O4/c1-12(25)23-6-7-24(19(28)17(23)9-14-10-21-11-22-14)16(18(20)27)8-13-2-4-15(26)5-3-13/h2-5,10-11,16-17,26H,6-9H2,1H3,(H2,20,27)(H,21,22)/t16-,17-/m0/s1
InChI key：
PDANTWUQXRJDPC-IRXDYDNUSA-N
SMILES：
CC(=O)N1CCN([C@@H](Cc2ccc(O)cc2)C(=O)N)C(=O)[C@@H]1Cc1c[nH]cn1
Systematic name (3)：
- (αS)-α-[(3S)-3-(1H-イミダゾール-4-イルメチル)-2-オキソ-4-アセチルピペラジノ]-4-ヒドロキシベンゼンプロパンアミド
- (2S)-2-[(3S)-4-アセチル-3-[(1H-イミダゾール-4-イル)メチル]-2-オキソピペラジン-1-イル]-3-(4-ヒドロキシフェニル)プロパンアミド
- (2S)-2-[(3S)-4-acetyl-3-[(1H-imidazol-4-yl)methyl]-2-oxopiperazin-1-yl]-3-(4-hydroxyphenyl)propanamide
- (αS)-α-[(3S)-3-(1H-Imidazole-4-ylmethyl)-2-oxo-4-acetylpiperazino]-4-hydroxybenzenepropanamide
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