Chem
J-GLOBAL ID：200907004301410773   Nikkaji number：J746.879B

PBIT

2-p-トリル-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： C14H11NOS
Molecular formula furigana： C14-H11-N-O-S
Molecular weight： 241.310
InChI： InChI=1S/C14H11NOS/c1-10-6-8-11(9-7-10)15-14(16)12-4-2-3-5-13(12)17-15/h2-9H,1H3
InChI key： KRXMYBAZKJBJAB-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)n1sc2ccccc2c1=O
Systematic name  (5)：
  • 2-p-トリル-1,2-ベンゾイソチアゾール-3(2H)-オン
  • 2-(4-メチルフェニル)-1,2-ベンゾイソチアゾール-3(2H)-オン
  • 2-(p-メチルフェニル)-1,2-ベンゾイソチアゾール-3(2H)-オン
  • 2-(4-メチルフェニル)-2,3-ジヒドロ-1,2-ベンゾチアゾール-3-オン
  • 2-(4-methylphenyl)-2,3-dihydro-1,2-benzothiazol-3-one
Other name (4)：
  • 2-p-Tolyl-1,2-benzisothiazol-3(2H)-one
  • 2-(4-Methylphenyl)-1,2-benzisothiazole-3(2H)-one
  • 2-(p-Methylphenyl)-1,2-benzoisothiazole-3(2H)-one
  • PBIT
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