2-(4-methylsulfanylphenyl)-2-pyrrolidin-1-yl-ethanenitrile

Systemtic Name: 2-(4-methylsulfanylphenyl)-2-pyrrolidin-1-yl-ethanenitrile Openeye Name: 2-(4-methylsulfanylphenyl)-2-pyrrolidin-1-yl-acetonitrile CAS Name: 2-[4-(methylthio)phenyl]-2-(1-pyrrolidinyl)acetonitrile IUPAC Name: 2-(4-methylsulfanylphenyl)-2-pyrrolidin-1-ylacetonitrile Traditional Name: 2-[4-(methylthio)phenyl]-2-pyrrolidino-acetonitrile Formula: C13H16N2S MolecularWeight: 232.34454

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C#N)N2CCCC2

Isomeric SMILES

CSC1=CC=C(C=C1)C(C#N)N2CCCC2

InChI

InChI=1S/C13H16N2S/c1-16-12-6-4-11(5-7-12)13(10-14)15-8-2-3-9-15/h4-7,13H,2-3,8-9H2,1H3