Chem
J-GLOBAL ID：200907064946726158
Nikkaji number：J1.533.704D
2-(3-Cyanopropylthio)benzonitrile
2-(3-シアノプロピルチオ)ベンゾニトリル
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： C11H10N2S
Molecular formula furigana： C11-H10-N2-S
Molecular weight： 202.280
InChI：
InChI=1S/C11H10N2S/c12-7-3-4-8-14-11-6-2-1-5-10(11)9-13/h1-2,5-6H,3-4,8H2
InChI key：
JYUPBBYYAUJZBD-UHFFFAOYSA-N
SMILES：
N#CCCCSc1ccccc1C#N
Systematic name (3)：
- 2-(3-シアノプロピルチオ)ベンゾニトリル
- 2-[(3-シアノプロピル)スルファニル]ベンゾニトリル
- 2-[(3-cyanopropyl)sulfanyl]benzonitrile
- 2-(3-Cyanopropylthio)benzonitrile
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