Chem
J-GLOBAL ID:200907083985444296   Nikkaji number:J567.619C

2,3-Dihydro-2-oxo-3β-[3-(4-chlorophenyl)ureido]-5-phenyl-1H-1,4-benzodiazepine-1-acetic acid ethyl ester

2,3-ジヒドロ-2-オキソ-3β-[3-(4-クロロフェニル)ウレイド]-5-フェニル-1H-1,4-ベンゾジアゼピン-1-酢酸エチル
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: C26H23ClN4O4
Molecular formula furigana: C26-H23-CL-N4-O4
Molecular weight: 490.940
InChI: InChI=1S/C26H23ClN4O4/c1-2-35-22(32)16-31-21-11-7-6-10-20(21)23(17-8-4-3-5-9-17)29-24(25(31)33)30-26(34)28-19-14-12-18(27)13-15-19/h3-15,24H,2,16H2,1H3,(H2,28,30,34)/t24-/m1/s1
InChI key: UCQCEIZNVJVIKL-XMMPIXPASA-N
SMILES: CCOC(=O)CN1c2ccccc2C(=N[C@H](NC(=O)Nc2ccc(Cl)cc2)C1=O)c1ccccc1
Systematic name  (3):
  • 2,3-ジヒドロ-2-オキソ-3β-[3-(4-クロロフェニル)ウレイド]-5-フェニル-1H-1,4-ベンゾジアゼピン-1-酢酸エチル
  • エチル 2-[(3S)-3-{[(4-クロロフェニル)カルバモイル]アミノ}-2-オキソ-5-フェニル-2,3-ジヒドロ-1H-1,4-ベンゾジアゼピン-1-イル]アセタート
  • ethyl 2-[(3S)-3-{[(4-chlorophenyl)carbamoyl]amino}-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]acetate
Other name (1):
  • 2,3-Dihydro-2-oxo-3β-[3-(4-chlorophenyl)ureido]-5-phenyl-1H-1,4-benzodiazepine-1-acetic acid ethyl ester
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