2-(3,4-dimethoxyphenyl)-2-pyridin-2-ylsulfanyl-ethanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-pyridin-2-ylsulfanyl-ethanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-(2-pyridylsulfanyl)acetonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-(2-pyridinylthio)acetonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-pyridin-2-ylsulfanylacetonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-(2-pyridylthio)acetonitrile Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)SC2=CC=CC=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)SC2=CC=CC=N2)OC

InChI

InChI=1S/C15H14N2O2S/c1-18-12-7-6-11(9-13(12)19-2)14(10-16)20-15-5-3-4-8-17-15/h3-9,14H,1-2H3