4-(2-butan-2-ylsulfanylethoxy)benzenecarbonitrile

Systemtic Name: 4-(2-butan-2-ylsulfanylethoxy)benzenecarbonitrile Openeye Name: 4-(2-sec-butylsulfanylethoxy)benzonitrile CAS Name: 4-[2-(butan-2-ylthio)ethoxy]benzonitrile IUPAC Name: 4-(2-butan-2-ylsulfanylethoxy)benzonitrile Traditional Name: 4-[2-(sec-butylthio)ethoxy]benzonitrile Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCCOC1=CC=C(C=C1)C#N

Isomeric SMILES

CCC(C)SCCOC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H17NOS/c1-3-11(2)16-9-8-15-13-6-4-12(10-14)5-7-13/h4-7,11H,3,8-9H2,1-2H3