3-methyl-2-methylsulfanyl-benzenecarbonitrile

Systemtic Name: 3-methyl-2-methylsulfanyl-benzenecarbonitrile Openeye Name: 3-methyl-2-methylsulfanyl-benzonitrile CAS Name: 3-methyl-2-(methylthio)benzonitrile IUPAC Name: 3-methyl-2-methylsulfanylbenzonitrile Traditional Name: 3-methyl-2-(methylthio)benzonitrile Formula: C9H9NS MolecularWeight: 163.23946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1SC)C#N

Isomeric SMILES

CC1=CC=CC(=C1SC)C#N

InChI

InChI=1S/C9H9NS/c1-7-4-3-5-8(6-10)9(7)11-2/h3-5H,1-2H3