3-(2-sulfanylethyl)benzenecarbonitrile

Systemtic Name: 3-(2-sulfanylethyl)benzenecarbonitrile Openeye Name: 3-(2-sulfanylethyl)benzonitrile CAS Name: 3-(2-mercaptoethyl)benzonitrile IUPAC Name: 3-(2-sulfanylethyl)benzonitrile Traditional Name: 3-(2-mercaptoethyl)benzonitrile Formula: C9H9NS MolecularWeight: 163.23946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CCS)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CCS)C#N

InChI

InChI=1S/C9H9NS/c10-7-9-3-1-2-8(6-9)4-5-11/h1-3,6,11H,4-5H2