2-(butan-2-ylsulfanylmethyl)benzenecarbonitrile

Systemtic Name: 2-(butan-2-ylsulfanylmethyl)benzenecarbonitrile Openeye Name: 2-(sec-butylsulfanylmethyl)benzonitrile CAS Name: 2-[(butan-2-ylthio)methyl]benzonitrile IUPAC Name: 2-(butan-2-ylsulfanylmethyl)benzonitrile Traditional Name: 2-[(sec-butylthio)methyl]benzonitrile Formula: C12H15NS MolecularWeight: 205.3192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC1=CC=CC=C1C#N

Isomeric SMILES

CCC(C)SCC1=CC=CC=C1C#N

InChI

InChI=1S/C12H15NS/c1-3-10(2)14-9-12-7-5-4-6-11(12)8-13/h4-7,10H,3,9H2,1-2H3