3-(2-methylsulfanylpyrimidin-4-yl)oxybenzenecarbonitrile

Systemtic Name: 3-(2-methylsulfanylpyrimidin-4-yl)oxybenzenecarbonitrile Openeye Name: 3-(2-methylsulfanylpyrimidin-4-yl)oxybenzonitrile CAS Name: 3-[[2-(methylthio)-4-pyrimidinyl]oxy]benzonitrile IUPAC Name: 3-(2-methylsulfanylpyrimidin-4-yl)oxybenzonitrile Traditional Name: 3-[2-(methylthio)pyrimidin-4-yl]oxybenzonitrile Formula: C12H9N3OS MolecularWeight: 243.28436

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)OC2=CC=CC(=C2)C#N

Isomeric SMILES

CSC1=NC=CC(=N1)OC2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H9N3OS/c1-17-12-14-6-5-11(15-12)16-10-4-2-3-9(7-10)8-13/h2-7H,1H3