Chem
J-GLOBAL ID：200907033355186500   Nikkaji number：J976.354F

1-(4-Hydroxybutyl)-3-(1H-indole-3-ylmethyl)-5-phenyl-1H-1,4-benzodiazepine-2(3H)-one

1-(4-ヒドロキシブチル)-3-(1H-インドール-3-イルメチル)-5-フェニル-1H-1,4-ベンゾジアゼピン-2(3H)-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： C28H27N3O2
Molecular formula furigana： C28-H27-N3-O2
Molecular weight： 437.543
InChI： InChI=1S/C28H27N3O2/c32-17-9-8-16-31-26-15-7-5-13-23(26)27(20-10-2-1-3-11-20)30-25(28(31)33)18-21-19-29-24-14-6-4-12-22(21)24/h1-7,10-15,19,25,29,32H,8-9,16-18H2
InChI key： VZNBRYCWDWVPDZ-UHFFFAOYSA-N
SMILES： OCCCCN1c2ccccc2C(=NC(Cc2c[nH]c3ccccc23)C1=O)c1ccccc1
Systematic name  (3)：
  • 1-(4-ヒドロキシブチル)-3-(1H-インドール-3-イルメチル)-5-フェニル-1H-1,4-ベンゾジアゼピン-2(3H)-オン
  • 1-(4-ヒドロキシブチル)-3-[(1H-インドール-3-イル)メチル]-5-フェニル-2,3-ジヒドロ-1H-1,4-ベンゾジアゼピン-2-オン
  • 1-(4-hydroxybutyl)-3-[(1H-indol-3-yl)methyl]-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one
Other name (1)：
  • 1-(4-Hydroxybutyl)-3-(1H-indole-3-ylmethyl)-5-phenyl-1H-1,4-benzodiazepine-2(3H)-one
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