Chem
J-GLOBAL ID：200907091402554415   Nikkaji number：J1.024.676H

5-[[4-[4-[(Isobutyl)(2-methylpropanoyl)amino]butyl]phenyl]acetyl]-5H-dibenzo[b,e][1,4]diazepine-11(10H)-one

5-[[4-[4-[(イソブチル)(2-メチルプロパノイル)アミノ]ブチル]フェニル]アセチル]-5H-ジベンゾ[b,e][1,4]ジアゼピン-11(10H)-オン
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： C33H39N3O3
Molecular formula furigana： C33-H39-N3-O3
Molecular weight： 525.693
InChI： InChI=1S/C33H39N3O3/c1-23(2)22-35(33(39)24(3)4)20-10-9-11-25-16-18-26(19-17-25)21-31(37)36-29-14-7-5-12-27(29)32(38)34-28-13-6-8-15-30(28)36/h5-8,12-19,23-24H,9-11,20-22H2,1-4H3,(H,34,38)
InChI key： YISYYMMEBKKLHP-UHFFFAOYSA-N
SMILES： CC(C)CN(CCCCc1ccc(CC(=O)n2c3ccccc3[nH]c(=O)c3ccccc23)cc1)C(=O)C(C)C
Systematic name  (3)：
  • 5-[[4-[4-[(イソブチル)(2-メチルプロパノイル)アミノ]ブチル]フェニル]アセチル]-5H-ジベンゾ[b,e][1,4]ジアゼピン-11(10H)-オン
  • 2-メチル-N-(2-メチルプロピル)-N-{4-[4-(2-オキソ-2-{10-オキソ-2,9-ジアザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-2-イル}エチル)フェニル]ブチル}プロパンアミド
  • 2-methyl-N-(2-methylpropyl)-N-{4-[4-(2-oxo-2-{10-oxo-2,9-diazatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}ethyl)phenyl]butyl}propanamide
Other name (1)：
  • 5-[[4-[4-[(Isobutyl)(2-methylpropanoyl)amino]butyl]phenyl]acetyl]-5H-dibenzo[b,e][1,4]diazepine-11(10H)-one
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