2-(6-methylsulfanylpyrimidin-4-yl)-2-phenyl-ethanenitrile

Systemtic Name: 2-(6-methylsulfanylpyrimidin-4-yl)-2-phenyl-ethanenitrile Openeye Name: 2-(6-methylsulfanylpyrimidin-4-yl)-2-phenyl-acetonitrile CAS Name: 2-[6-(methylthio)-4-pyrimidinyl]-2-phenylacetonitrile IUPAC Name: 2-(6-methylsulfanylpyrimidin-4-yl)-2-phenylacetonitrile Traditional Name: 2-[6-(methylthio)pyrimidin-4-yl]-2-phenyl-acetonitrile Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC(=C1)C(C#N)C2=CC=CC=C2

Isomeric SMILES

CSC1=NC=NC(=C1)C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3S/c1-17-13-7-12(15-9-16-13)11(8-14)10-5-3-2-4-6-10/h2-7,9,11H,1H3