Chem
J-GLOBAL ID：200907073542008730   Nikkaji number：J1.728.654D

2-(4-Chlorobenzyl)-1,2-benzisothiazole-3(2H)-one

2-(4-クロロベンジル)-1,2-ベンゾイソチアゾール-3(2H)-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： C14H10ClNOS
Molecular formula furigana： C14-H10-CL-N-O-S
Molecular weight： 275.750
InChI： InChI=1S/C14H10ClNOS/c15-11-7-5-10(6-8-11)9-16-14(17)12-3-1-2-4-13(12)18-16/h1-8H,9H2
InChI key： GQBVBBSACQRWPC-UHFFFAOYSA-N
SMILES： Clc1ccc(Cn2sc3ccccc3c2=O)cc1
Systematic name  (3)：
  • 2-(4-クロロベンジル)-1,2-ベンゾイソチアゾール-3(2H)-オン
  • 2-[(4-クロロフェニル)メチル]-2,3-ジヒドロ-1,2-ベンゾチアゾール-3-オン
  • 2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,2-benzothiazol-3-one
Other name (1)：
  • 2-(4-Chlorobenzyl)-1,2-benzisothiazole-3(2H)-one
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