Chem
J-GLOBAL ID：200907050003061440
Nikkaji number：J880.333A
3-[(Hydroxyimino)methyl]-2-phenylpyrrolo[2,1-b]benzothiazole-1-carbaldehyde
3-[(ヒドロキシイミノ)メチル]-2-フェニルピロロ[2,1-b]ベンゾチアゾール-1-カルボアルデヒド
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
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
Molecular formula： C18H12N2O2S
Molecular formula furigana： C18-H12-N2-O2-S
Molecular weight： 320.370
InChI：
InChI=1S/C18H12N2O2S/c21-11-15-17(12-6-2-1-3-7-12)13(10-19-22)18-20(15)14-8-4-5-9-16(14)23-18/h1-11,22H
InChI key：
URPFVDWCJQOFNZ-UHFFFAOYSA-N
SMILES：
ON=Cc1c(c(C=O)n2c1sc1ccccc21)c1ccccc1
Systematic name (3)：
- 3-[(ヒドロキシイミノ)メチル]-2-フェニルピロロ[2,1-b]ベンゾチアゾール-1-カルボアルデヒド
- 5-[(ヒドロキシイミノ)メチル]-4-フェニル-7-チア-2-アザトリシクロ[6.4.0.02,6]ドデカ-1(12),3,5,8,10-ペンタエン-3-カルバルデヒド
- 5-[(hydroxyimino)methyl]-4-phenyl-7-thia-2-azatricyclo[6.4.0.02,6]dodeca-1(12),3,5,8,10-pentaene-3-carbaldehyde
- 3-[(Hydroxyimino)methyl]-2-phenylpyrrolo[2,1-b]benzothiazole-1-carbaldehyde
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