Chem
J-GLOBAL ID：200907099952327506   Nikkaji number：J2.438.636H

3-Cyano-5-nitro-1,2-benzoisothiazole

3-シアノ-5-ニトロ-1,2-ベンゾイソチアゾール
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： C8H3N2[N+]O[O-]S
Molecular formula furigana： C8-H3-N3-O2-S
Molecular weight： 205.190
InChI： InChI=1S/C8H3N3O2S/c9-4-7-6-3-5(11(12)13)1-2-8(6)14-10-7/h1-3H
InChI key： GRUQWHSYFXBRBC-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc2snc(C#N)c2c1
Systematic name  (4)：
  • 5-ニトロ-1,2-ベンゾイソチアゾール-3-カルボニトリル
  • 3-シアノ-5-ニトロ-1,2-ベンゾイソチアゾール
  • 5-ニトロ-1,2-ベンゾチアゾール-3-カルボニトリル
  • 5-nitro-1,2-benzothiazole-3-carbonitrile
Other name (2)：
  • 5-Nitro-1,2-benzoisothiazole-3-carbonitrile
  • 3-Cyano-5-nitro-1,2-benzoisothiazole
Thsaurus map：
Thesaurus Map

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