Chem
J-GLOBAL ID:200907053394231858   Nikkaji number:J1.024.654G

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

2-(ベンジルオキシカルボニルアミノ)-5-[[4-[4-(ジイソブチルアミノ)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: C41H48N4O4
Molecular formula furigana: C41-H48-N4-O4
Molecular weight: 660.859
InChI: InChI=1S/C41H48N4O4/c1-29(2)26-44(27-30(3)4)23-11-10-12-31-17-19-32(20-18-31)24-39(46)45-37-22-21-34(42-41(48)49-28-33-13-6-5-7-14-33)25-35(37)40(47)43-36-15-8-9-16-38(36)45/h5-9,13-22,25,29-30H,10-12,23-24,26-28H2,1-4H3,(H,42,48)(H,43,47)
InChI key: DLSOQUYMDXICNT-UHFFFAOYSA-N
SMILES: CC(C)CN(CCCCc1ccc(CC(=O)n2c3ccccc3[nH]c(=O)c3cc(NC(=O)OCc4ccccc4)ccc23)cc1)CC(C)C
Systematic name  (3):
  • 2-(ベンジルオキシカルボニルアミノ)-5-[[4-[4-(ジイソブチルアミノ)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
  • ベンジル N-{2-[2-(4-{4-[ビス(2-メチルプロピル)アミノ]ブチル}フェニル)アセチル]-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-13-イル}カルバマート
  • benzyl N-{2-[2-(4-{4-[bis(2-methylpropyl)amino]butyl}phenyl)acetyl]-10-oxo-2,9-diazatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-13-yl}carbamate
Other name (1):
  • 2-(Benzyloxycarbonylamino)-5-[[4-[4-(diisobutylamino)butyl]phenyl]acetyl]-5H-dibenzo[b,e][1,4]diazepine-11(10H)-one
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