Chem
J-GLOBAL ID:200907003054172035   Nikkaji number:J900.580C

3-Oxo-4,6,7-trichloro-2,3-dihydro-1,2-benzisothiazole-5-carbonitrile

4,6,7-トリクロロ-3-オキソ-2,3-ジヒドロ-1,2-ベンゾチアゾール-5-カルボニトリル
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: C8HCl3N2OS
Molecular formula furigana: C8-H-CL3-N2-O-S
Molecular weight: 279.520
InChI: InChI=1S/C8HCl3N2OS/c9-4-2(1-12)5(10)6(11)7-3(4)8(14)13-15-7/h(H,13,14)
InChI key: YPRODELPHDPBGE-UHFFFAOYSA-N
SMILES: Clc1c(Cl)c2s[nH]c(=O)c2c(Cl)c1C#N
Systematic name  (3):
  • 3-オキソ-4,6,7-トリクロロ-2,3-ジヒドロ-1,2-ベンゾイソチアゾール-5-カルボニトリル
  • 4,6,7-トリクロロ-3-オキソ-2,3-ジヒドロ-1,2-ベンゾチアゾール-5-カルボニトリル
  • 4,6,7-trichloro-3-oxo-2,3-dihydro-1,2-benzothiazole-5-carbonitrile
Other name (1):
  • 3-Oxo-4,6,7-trichloro-2,3-dihydro-1,2-benzisothiazole-5-carbonitrile
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