Chem
J-GLOBAL ID:200907050382644457   Nikkaji number:J612.014H

2,3-Dihydro-8-chloro-2-(4-hydroxyphenyl)-3-acetoxy-5-[2-(dimethylamino)ethyl]-1,5-benzothiazepin-4(5H)-one

2,3-ジヒドロ-8-クロロ-2-(4-ヒドロキシフェニル)-3-アセトキシ-5-[2-(ジメチルアミノ)エチル]-1,5-ベンゾチアゼピン-4(5H)-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: C21H23ClN2O4S
Molecular formula furigana: C21-H23-CL-N2-O4-S
Molecular weight: 434.940
InChI: InChI=1S/C21H23ClN2O4S/c1-13(25)28-19-20(14-4-7-16(26)8-5-14)29-18-12-15(22)6-9-17(18)24(21(19)27)11-10-23(2)3/h4-9,12,19-20,26H,10-11H2,1-3H3
InChI key: JTSLHFVGWNDJRN-UHFFFAOYSA-N
SMILES: CN(C)CCN1c2ccc(Cl)cc2SC(C(OC(=O)C)C1=O)c1ccc(O)cc1
Systematic name  (3):
  • 2,3-ジヒドロ-8-クロロ-2-(4-ヒドロキシフェニル)-3-アセトキシ-5-[2-(ジメチルアミノ)エチル]-1,5-ベンゾチアゼピン-4(5H)-オン
  • 8-クロロ-5-[2-(ジメチルアミノ)エチル]-2-(4-ヒドロキシフェニル)-4-オキソ-2,3,4,5-テトラヒドロ-1,5-ベンゾチアゼピン-3-イル アセタート
  • 8-chloro-5-[2-(dimethylamino)ethyl]-2-(4-hydroxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
Other name (1):
  • 2,3-Dihydro-8-chloro-2-(4-hydroxyphenyl)-3-acetoxy-5-[2-(dimethylamino)ethyl]-1,5-benzothiazepin-4(5H)-one
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