3-(2-methylsulfonylpyrimidin-4-yl)benzenecarbonitrile

Systemtic Name: 3-(2-methylsulfonylpyrimidin-4-yl)benzenecarbonitrile Openeye Name: 3-(2-methylsulfonylpyrimidin-4-yl)benzonitrile CAS Name: 3-(2-methylsulfonyl-4-pyrimidinyl)benzonitrile IUPAC Name: 3-(2-methylsulfonylpyrimidin-4-yl)benzonitrile Traditional Name: 3-(2-mesylpyrimidin-4-yl)benzonitrile Formula: C12H9N3O2S MolecularWeight: 259.28376

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=CC(=N1)C2=CC=CC(=C2)C#N

Isomeric SMILES

CS(=O)(=O)C1=NC=CC(=N1)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H9N3O2S/c1-18(16,17)12-14-6-5-11(15-12)10-4-2-3-9(7-10)8-13/h2-7H,1H3