2-methyl-3-(4-propan-2-ylphenyl)sulfanyl-propanenitrile

Systemtic Name: 2-methyl-3-(4-propan-2-ylphenyl)sulfanyl-propanenitrile Openeye Name: 3-(4-isopropylphenyl)sulfanyl-2-methyl-propanenitrile CAS Name: 2-methyl-3-[(4-propan-2-ylphenyl)thio]propanenitrile IUPAC Name: 2-methyl-3-(4-propan-2-ylphenyl)sulfanylpropanenitrile Traditional Name: 2-methyl-3-(p-cumenylthio)propionitrile Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NS/c1-10(2)12-4-6-13(7-5-12)15-9-11(3)8-14/h4-7,10-11H,9H2,1-3H3