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
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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:
C26 H23 ClN4 O4
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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