2-(4-oxidanylidenebutylsulfanyl)benzenecarbonitrile

Systemtic Name: 2-(4-oxidanylidenebutylsulfanyl)benzenecarbonitrile Openeye Name: 2-(4-oxobutylsulfanyl)benzonitrile CAS Name: 2-(4-oxobutylthio)benzonitrile IUPAC Name: 2-(4-oxobutylsulfanyl)benzonitrile Traditional Name: 2-(4-ketobutylthio)benzonitrile Formula: C11H11NOS MolecularWeight: 205.27614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SCCCC=O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SCCCC=O

InChI

InChI=1S/C11H11NOS/c12-9-10-5-1-2-6-11(10)14-8-4-3-7-13/h1-2,5-7H,3-4,8H2