Chem
J-GLOBAL ID:200907025134167680   Nikkaji number:J1.118.384K

(2S)-3-Oxo-4-methyl-7-[2-(phenylamino)ethylcarbamoyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2-acetic acid

(2S)-3-オキソ-4-メチル-7-[2-(フェニルアミノ)エチルカルバモイル]-2,3,4,5-テトラヒドロ-1H-1,4-ベンゾジアゼピン-2-酢酸
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: C21H24N4O4
Molecular formula furigana: C21-H24-N4-O4
Molecular weight: 396.447
InChI: InChI=1S/C21H24N4O4/c1-25-13-15-11-14(7-8-17(15)24-18(21(25)29)12-19(26)27)20(28)23-10-9-22-16-5-3-2-4-6-16/h2-8,11,18,22,24H,9-10,12-13H2,1H3,(H,23,28)(H,26,27)/t18-/m0/s1
InChI key: ZIQYUBASERVYOD-SFHVURJKSA-N
SMILES: CN1Cc2cc(ccc2N[C@@H](CC(=O)O)C1=O)C(=O)NCCNc1ccccc1
Systematic name  (3):
  • (2S)-3-オキソ-4-メチル-7-[2-(フェニルアミノ)エチルカルバモイル]-2,3,4,5-テトラヒドロ-1H-1,4-ベンゾジアゼピン-2-酢酸
  • 2-[(2S)-4-メチル-3-オキソ-7-{[2-(フェニルアミノ)エチル]カルバモイル}-2,3,4,5-テトラヒドロ-1H-1,4-ベンゾジアゼピン-2-イル]酢酸
  • 2-[(2S)-4-methyl-3-oxo-7-{[2-(phenylamino)ethyl]carbamoyl}-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-yl]acetic acid
Other name (1):
  • (2S)-3-Oxo-4-methyl-7-[2-(phenylamino)ethylcarbamoyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2-acetic acid
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